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Octanoic acid, 8-(octylthio)-

View entire compound with spectra: 1 MS (GC)

Octanoic acid, 8-(octylthio)-
SpectraBase Compound ID FWEyGLVvaP6
InChI InChI=1S/C16H32O2S/c1-2-3-4-5-8-11-14-19-15-12-9-6-7-10-13-16(17)18/h2-15H2,1H3,(H,17,18)
InChIKey IHBAHSFQZFRVJU-UHFFFAOYSA-N
Mol Weight 288.5 g/mol
Molecular Formula C16H32O2S
Exact Mass 288.212301 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L38Nb5ji394
Name Octanoic acid, 8-(octylthio)-
CAS Registry Number 56909-05-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H32O2S
InChI InChI=1S/C16H32O2S/c1-2-3-4-5-8-11-14-19-15-12-9-6-7-10-13-16(17)18/h2-15H2,1H3,(H,17,18)
InChIKey IHBAHSFQZFRVJU-UHFFFAOYSA-N
Molecular Weight 288.490 g/mol
SMILES OC(CCCCCCCSCCCCCCCC)=O
SPLASH splash10-054o-9200000000-5ca32db2f14096478ebe
Source of Spectrum EP-4860-0-0
Synonyms 8-(Octylsulfanyl)octanoic acid 8-(octylthio)caprylic acid 8-(octylthio)octanoic acid
Wiley ID 1291770