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Benzenenonanethiol, .eta.-(phenylsulfonyl)-
SpectraBase Compound ID 4KXZo7dunqR
InChI InChI=1S/C21H28O2S2/c22-25(23,20-13-8-4-9-14-20)21(15-7-1-2-10-18-24)17-16-19-11-5-3-6-12-19/h3-6,8-9,11-14,21,24H,1-2,7,10,15-18H2
InChIKey IESKLQPMWQKAFQ-UHFFFAOYSA-N
Mol Weight 376.57 g/mol
Molecular Formula C21H28O2S2
Exact Mass 376.153072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWghzYgaJBP
Name Benzenenonanethiol, .eta.-(phenylsulfonyl)-
Alternate Name(s) 9-Phenyl-7-(phenylsulfonyl)-1-nonanethiol 9-Phenyl-7-(phenylsulfonyl)nonanyl mercaptan 9-Phenyl-7-(phenylsulfonyl)nonyl hydrosulfide
CAS Registry Number 130220-25-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28O2S2
InChI InChI=1S/C21H28O2S2/c22-25(23,20-13-8-4-9-14-20)21(15-7-1-2-10-18-24)17-16-19-11-5-3-6-12-19/h3-6,8-9,11-14,21,24H,1-2,7,10,15-18H2
InChIKey IESKLQPMWQKAFQ-UHFFFAOYSA-N
Molecular Weight 376.573 g/mol
SMILES SCCCCCCC(S(=O)(=O)c1ccccc1)CCc1ccccc1
SPLASH splash10-0006-9110000000-c2dd961e3ca6836612ed
Source of Spectrum C-112-8089-13
Wiley ID 1357734