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(1-Thiabutyl)benzene

View entire compound with spectra: 1 NMR, and 8 MS (GC)

(1-Thiabutyl)benzene
SpectraBase Compound ID DvZhm4EOCtI
InChI InChI=1S/C9H12S/c1-2-8-10-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3
InChIKey NWYDLOBJQIJDGH-UHFFFAOYSA-N
Mol Weight 152.25 g/mol
Molecular Formula C9H12S
Exact Mass 152.065972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DUi3lLQ77gs
Name (1-Thiabutyl)benzene
CAS Registry Number 874-79-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12S
InChI InChI=1S/C9H12S/c1-2-8-10-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3
InChIKey NWYDLOBJQIJDGH-UHFFFAOYSA-N
Molecular Weight 152.255 g/mol
SMILES c1(SCCC)ccccc1
SPLASH splash10-0ik9-0900000000-762534dfabd357124098
Source of Spectrum J-58-6764-23
Synonyms Benzene, (propylthio)- (Propylsulfanyl)benzene (Propylthio)benzene Fenyl-propylsulfid n-Propyl phenyl sulfide Phenyl propyl sulfide Propyl phenyl sulfide Propylsulfanylbenzene Sulfide, phenyl propyl BRN 1857536 NSC 115079
Wiley ID 1149193