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(5S)-3-(cyclohexylthio)-5-octyl-2-oxolanone
SpectraBase Compound ID 69TyCUMA41M
InChI InChI=1S/C18H32O2S/c1-2-3-4-5-6-8-11-15-14-17(18(19)20-15)21-16-12-9-7-10-13-16/h15-17H,2-14H2,1H3/t15-,17?/m0/s1
InChIKey VLULCYQWAKVPDC-MYJWUSKBSA-N
Mol Weight 312.5 g/mol
Molecular Formula C18H32O2S
Exact Mass 312.212301 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ce2KXvyBDcZ
Name (5S)-3-(cyclohexylthio)-5-octyl-2-oxolanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H32O2S
InChI InChI=1S/C18H32O2S/c1-2-3-4-5-6-8-11-15-14-17(18(19)20-15)21-16-12-9-7-10-13-16/h15-17H,2-14H2,1H3/t15-,17?/m0/s1
InChIKey VLULCYQWAKVPDC-MYJWUSKBSA-N
Molecular Weight 312.512 g/mol
SMILES C1(O[C@@](CCCCCCCC)(CC1SC1CCCCC1)[H])=O
SPLASH splash10-03yi-6900000000-90a8a2958af50e09c53c
Source of Spectrum K1-0-1938-25
Synonyms (5S)-3-(cyclohexylthio)-5-octyl-tetrahydrofuran-2-one (5S)-3-cyclohexylsulfanyl-5-octyl-oxolan-2-one (5S)-3-cyclohexylsulfanyl-5-octyl-tetrahydrofuran-2-one
Wiley ID 1588777