• 한국식품조리과학회지
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• 제14권5호
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• pp.547-552
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• 1998

신선한 섬쑥부쟁이의 휘발성 향미성분을 분석하여 31가지의 peak를 확인하였다. 확인된 휘발성 향미성분은 탄화수소류가 17종으로 peak area 58.90%이었으며, 알코올류 7종 8.51%, 에스테르류 3종 2.1%, 옥사이드류 1종 2.10%, 산류 1종 1.65% 및 알데히드류 1종 0.48%로 나타났다. 섬쑥부쟁이의 주요 휘발성 향미성분은 $\alpha$-pinene, limonene, $\delta$-elemene, $\beta$-pinene, cis-3-hexenol 및 myrcene으로 사료된다. 신선한 섬쑥부쟁이를 전자코로 분석한 결과 알코올과 같은 극성화합물을 민감하게 감지하는 PA2 sensor의 저항값이 가장 높게 나타났다. 건조된 섬쑥부쟁이의 휘발성 향미성분의 패턴은 신선한 시료와 동일하였으나, 6개의 metal oxide sensor의 저항값은 신선한 시료 보다 모두 크게 나타났다. 또한 전자코에 의한 신선한 시료와 건조된 시료의 향미성분의 강도 비교는 관능검사와 일치하였다.

• 분석과학
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• 제13권2호
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• pp.136-150
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• 2000

생체시료에서 미지 의약품의 검출을 위하여, 민감하고 선택적인 박층크로마토그래피인 자동화 점적기 및 자외선 스펙트럼 검출기를 장착한 고성능박층크로마토그라피(HPTLC)를 시도하였다. 205종의 의약품에 대한 Rf값과 자외선흡수스펙트럼(scan 200-360 nm)을 이용하여 HPTLC 데이터베이스를 구축하였으며, 또한 96종의 의약품에 대하여는 리도카인에 대한 상대적 머무름시간(relative retention time; RRT) 및 질량스펙트럼을 이용하여 GC/MS 데이터베이스를 구축하였다. 생체시료중 의약품성분은 고상추출법(Clean Screen ZSDAU020)으로 추출한 후, 이들 시료들을 HPTLC 및 GC/MS 데이터베이스에 적용시켜 검색한 결과 90% 이상의 매우 양호한 일치율로 검색할 수 있었으며, 이들 의약품들을 GC/MS로 확인하였다. 결론적으로, 우리가 구축한 HPTLC 및 GC/MS 데이터베이스체계는 생체시료에서 미지의 의약품성분을 검색하는데 매우 유용한 방법으로 사료된다.

• 분석과학
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• 제27권1호
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• pp.22-26
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• 2014

1,4-dioxane은 국제 암연구소에서 2B의 발암물질로 분류하고 있는 물질이다.지표수 중에 1,4-dioxane을 headspace gas chromatographic mass spectrometry에 의해 측정하였다. 시료 5 mL를 10 mL 헤드스페이스 vial에서 넣고 NaCl로 포화시킨 후 내부표준물질로 1,4-dioxane-d8 첨가한 후 $90^{\circ}C$에서 30분간 가열하였다. 위의 방법을 사용하여 금강 22개 지점에서 2012년 6월과 9월 시료 채취하여 분석한 결과 $0.49-43.0{\mu}g/L$ (평균 $2.0{\mu}g/L$)의 범위로 약 30%의 빈도로 검출되었다.

• 보존과학회지
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• 제34권5호
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• pp.369-377
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• 2018

경북 경산에 위치한 원삼국시대 고분인 임당1호분에서 출토된 칠초 철제 고리자루칼의 칠편에 대해 칠의 구성성분과 풍화상태를 확인하기 위해 열분해/GC/MS법으로 유기물을 분석하였다. 직접 열분해/GC/MS법에서 칠편과 원주산 건조옻이 대체적으로 유사한 크로마토그램을 보였다. THM(thermally assisted hydrolysis and methylation)-열분해/GC/MS법의 경우 칠편에서 한국에 자생하는 옻나무 종의 특징적인 성분(1,2-dimethoxy-3-pentadecylbenzene 등)이 관찰되었다. 또한, dimethyl nonanedioate 등 건성유에서 비롯되는 것으로 보이는 성분도 검출되었다. 칠편에서 산화된 catechol 성분이 다량 검출되는 것으로 보아 칠의 열화가 우루시올 성분의 산화와 관련 있을 것으로 추정된다. 이로부터 임당1호분 고리자루칼 칠은 옻과 건성유를 사용하였고 오랜 시간의 경과로 산화가 많이 진행된 상태인 것으로 판단된다.

• 통합자연과학논문집
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• 제11권3호
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• pp.161-164
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• 2018

Over the past decade, mass spectrometry-based metabolomics, especially two dimensional gas chromatography mass spectrometry (GCxGC/TOF-MS), has become a key analytical tool for metabolomics data because of its sensitivity and ability to analyze complex biological or biochemical sample. However, the need to reduce variations within/between experiments has been reported and methodological developments to overcome such problem has long been a critical issue. Along with methodological developments, developing reasonable performance measure has also been studied. Following four numerical measures have been typically used for comparison: sensitivity, specificity, receiver operating characteristic (ROC) curves, and positive predictive value (PPV). However, more recently, such measures are replaced with F1 score in many fields including metabolomics area without any carefulness of its validity. Thus, we want to investigate the validity of F1 score on two examples, with the goal of raising the awareness in choosing appropriate performance comparison measure. We noticed that F1 score itself, as a performance measure, was not good enough. Accordingly, we suggest that F1 score be supplemented with other performance measure such as specificity to improve its validity.

• Environmental Analysis Health and Toxicology
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• 제20권4호통권51호
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• pp.297-302
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• 2005

The purpose of this study was to provide the standard method for the analysis of organophosphorous pesticides such as chlorpyrifos, diazinon, malathion and parathion in blood. We performed method validation for these pesticides in blood according to EURACHEM (A focus For Analytical Chemistry in Europe) guide. For the analysis of the pesticides, we used solid-phase extraction ,column (Waters Oasis $HLB^{(R)}$. After the extraction, the supernatants were evaporated to dryness under the nitrogen stream. They were analyzed by gas chromatography/mass spectrometry (GC/MS) after reconstituting with ethanol. Terbufos was used as an internal standard. To validate this method, we performed verification procedures with the following parameters: selectivity, linearity of calibration, accuracy, precision, limit of detection and quantification. Validation data according to Eurachem guide were adequate for our purpose for the analysis of chlorpyrifos, diazinon, malathion and parathion in blood.

• 한국식품과학회지
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• 제47권2호
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• pp.176-183
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• 2015

고온반응기로 제조한 구운 불고기 반응향의 향미특성을 확인하기 위하여 휘발성 성분 및 향 활성 화합물을 동정하고 반응온도에 따른 향 활성 화합물의 변화를 확인하기 위하여 수증기증류 및 용매 동시추출법(SDE)을 이용하여 휘발성 향기성분을 추출하고, gas chromatography-mass spectrometry-olfactometry (GC-MS-O)를 통하여 비교 분석하였다. 고온반응기로 제조한 구운 불고기 반응향에서는 105종의 휘발성 성분이 동정되었으며, 이 중 furfural이 가장 높은 함량을 나타내었으며, 5-methyl furfural, phenylacetaldehyde 및 nonanal 등이 구운 불고기 반응향에 중요한 휘발성 성분으로 확인되었다. 또한 GC-MS-O를 통해 향 활성 성분을 분석한 결과 33종이 동정되었으며, 2,3-butanedione과 furfural 이 중요한 향 활성 화합물로 밝혀졌다. Hexanal, octanal, nonanal, undecanal, phenylacetaldehyde, 5-methyl furfural, 2,6-dimethyl pyrazine 및 dimethyl trisulfide도 구운 불고기 반응향의 향미특성에 중요한 역할을 하는 향 활성 성분으로 확인되었다. 반응온도에 따른 향 활성성분을 비교분석한 결과, 반응온도가 증가할수록 향 활성 성분도 증가하였으나, sulfide 화합물은 반응온도가 증가함에 따라 감소하였다.

• Food Science and Biotechnology
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• 제17권3호
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• pp.669-674
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• 2008

Zanthoxylum schinifolium and Zanthoxylum piperitum A.P. DC. belong to the Rutaceae family and are perennial, aromatic, and medicinal herbaceous plants. In this study, their aroma compounds were isolated by steam distillation extraction using a Clevenger-type apparatus, and then further analyzed by gas chromatography (GC) and gas chromatograph/mass spectrometry (GC/MS). The yields of the essential oils from Z. schinifolium and Z. piperitum AP. DC. were 2.5 and 2.0%(w/w), respectively, and the color of their oils was quite similar, a pale yellow. From the distilled oil of Z. schinifolium, 60 volatile compounds which make up 87.24% of the total composition were tentatively identified, with monoterpenes predominating. $\beta$-Phellandrene (22.54%), citronellal (16.48%), and geranyl acetate (11.39%) were the predominantly abundant components of Z. schinifolium. In the essential oil of Z. piperitum AP. DC., 60 volatile flavor components constituted 94.78% of the total peak area were tentatively characterized. Limonene (18.04%), geranyl acetate (15.33%), and cryptone (8.52%) were the major volatile flavor compounds of Z. piperitum A.P. DC.

• Journal of Microbiology and Biotechnology
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• 제23권2호
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• pp.177-183
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• 2013

Bacterial blight, an important and potentially destructive bacterial disease in rice caused by Xanthomonas oryzae pv. oryzae (Xoo), has recently developed resistance to the available antibiotics. In this study, mass spectrometry (MS)-based metabolite profiling and multivariate analysis were employed to investigate the correlation between timedependent metabolite changes and antimicrobial activities against Xoo over the course of Phomopsis longicolla S1B4 fermentation. Metabolites were clearly differentiated based on fermentation time into phase 1 (days 4-8) and phase 2 (days 10-20) in the principal component analysis (PCA) plot. The multivariate statistical analysis showed that the metabolites contributing significantly for phases 1 and 2 were deacetylphomoxanthone B, monodeacetylphomoxanthone B, fusaristatin A, and dicerandrols A, B, and C as identified by liquid chromatography-mass spectrometry (LC-MS), and dimethylglycine, isobutyric acid, pyruvic acid, ribofuranose, galactofuranose, fructose, arabinose, hexitol, myristic acid, and propylstearic acid were identified by gas chromatography-mass spectrometry (GC-MS)-based metabolite profiling. The most significantly different secondary metabolites, especially deacetylphomoxanthone B, monodeacetylphomoxanthone B, and dicerandrol A, B and C, were positively correlated with antibacterial activity against Xoo during fermentation.

• Journal of Ginseng Research
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• 제14권3호
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• pp.353-356
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• 1990

The isolation of volatile compounds by vacuum-distillation with freeze-drying was tested 1 with fresh ginseng roots. The roots were frozen at-8$0^{\circ}C$; they were dried at-4$0^{\circ}C$ tinder vacuum(40 tory), for 24 hours; and the ice condensed at the silrface of condenser in the freeze-dryer was thauved at room temperature. The ether extract of the resulting aqueous solution was analyzed by gas chromatography (GC) equipped with a flame ionization detector (FID) or a nitrogen-phosphorils detecto(NPD) and by gas : chromatography/mass spectrometry(GC/MS). More than forty peaks were observed in the CG(FID) profile. and more than ten peaks were observed in the GC(NPD) profile. Among them, thirteen components 1including one aldehyde, four hydrocarbons, two esters, folly alcohols, and two vyrazines were identified: six components the molesuiar ions of which were m/z, 204 were estimated to be a series of azulene compounds; and the other components unidentified were estimated to have molecular weights of lower than 254. Therefore, the freeze-drying technicue is thought to be usefu1 for the isolation of volatile compounds of such low molecufilar weights from vegetables, fruits and biological fluids as well as fresh ginseng roots under the tested conditions.