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. 2018 Apr 23;12(4):e0006423. doi: 10.1371/journal.pntd.0006423

Table 1. Tentative identification of VOCs released in vitro by the eight bacterial strains tested.

VOCs are listed according to their retention times.

Tentative identification Ret time (min) Bee Bes Cke Cks Dne Dns Mle Mls Sce Scs Ske Sks See Ses Swe Sws
Carbon dioxidea 2,43 +++ ++ + + +++ +++ +++ ++ +++ +++ +++ +++ ++ ++ +++ +++
Methanethiola 3,15 + + + +
*Acetonea 3,82 + + ++
*Hexanea 5,76 + + +
Trichloromethanea 6,30 + + +
**1-Butanola 7,44 + + ++
Methyl-thioacetatea 8,81 + + + +
*Disulfide, dimethyla 10,80 + ++ + ++ + + + + + +
*Toluenea 11,72 + + + +
*Butanoic acid, 2-methyl-methyl estera 11,96 +
S-methyl-propanethioatea 12,98 + + +
**Butanoic acid-3-methyla 14,20 + + + +
**Butanoic acid-2-methyla 14,71 +
Acetic acid, 3-methylbutyl estera 16,72 + ++
2-Heptanonea 17,50 + + + +
Butanethioic acid-S-methyl estera 17,55 + +
Unknown-1 17,94 +
Thiopivalic acida 20,34 + +
*Phenola 22,05 + + + + + + +
Trisulfide, dimethyla 22,39 + + + + + +
Unknown-2 25,15 +
Benzeneacetaldehydea 26,03 + + + + + +
1-Octanola 26,96 + +
Hexanethioic acid, S-methyl estera 28,40 +
*Phenylethyl alcohola 29,67 + + + + + + + + +
Benzylmethyl cetonea 30,47 + + +
Sulfide-1 30,69 +
Benzeneethanol-a-methyla 30,72 +
Nonanonea 31,55 + +
Alcohol-1 32,13 +
Tetrasulfide, dimethyla 35,51 +
Undecanonea 36,51 + +
1-Decanola 37,11 + + + +
*Indolea 38,79 + + +++ ++ + + ++ + ++ + + + +++ + + +
Cyclopentaneundecanoic acid, methyl estera 39,54 +
Aromatic-1 41,48 +
1-Undecanola 41,75 +
Benzyl cetone unknown 41,79 + +
Alcohol-2 45,68 +
Alcohol-3 46,19 + +
Alcohol-4 46,73 +
Cetone-4 47,19 + +
Tetradecanonea 54,30 +
Aromatic with nitrogen 55,24 + +
*Hexadecanoic acid, methyl estera 56,48 + +
Methyl ester-1 62,19 + +

a = Compounds identified based on comparison of mass spectra with NIST14 Mass Spectral Library and analysis of their EI fragmentation partners.

* = VOCs reported as emanations from human skin by Bernier et al. (2000) [7].

** = VOCs reported as released by bacteria isolated from human skin by Verhulst et al. (2009) [8]. Ret time (min) = Retention time in minutes.

Average area percentage for each sample is represented as +++. High intensity: 50–100%, ++; medium intensity: 20–50%, +; low intensity: 0.01–20%. Bee = B. epidermidis exponential phase, Bes = B. epidermidis stationary phase, Cke = C. koseri 6P exponential phase, Cks = C. koseri 6P stationary phase, Dne = D. nishinomiyaensis 9C exponential phase, Dns = D. nishinomiyaensis 9C stationary phase, Mle = M. luteus 23 exponential phase, Mls = M. luteus 23 stationary phase, Sce = S. capitis 11C exponential phase, Scs = S. capitis 11C stationary phase, Ske = S. caprae 7P exponential phase, Sks = S. caprae 7P stationary phase, See = S. epidermidis exponential phase, Ses = S. epidermidis stationary phase, Swe = S. warneri exponential phase, Sws = S. warneri stationary phase.