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Benzo[b]thiophene, 2-(pentylthio)-
SpectraBase Compound ID LIuhccTw2dW
InChI InChI=1S/C13H16S2/c1-2-3-6-9-14-13-10-11-7-4-5-8-12(11)15-13/h4-5,7-8,10H,2-3,6,9H2,1H3
InChIKey PWEZONLPHGGEGD-UHFFFAOYSA-N
Mol Weight 236.39 g/mol
Molecular Formula C13H16S2
Exact Mass 236.069343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9QSTrbSXdL0
Name Benzo[b]thiophene, 2-(pentylthio)-
CAS Registry Number 54833-36-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16S2
InChI InChI=1S/C13H16S2/c1-2-3-6-9-14-13-10-11-7-4-5-8-12(11)15-13/h4-5,7-8,10H,2-3,6,9H2,1H3
InChIKey PWEZONLPHGGEGD-UHFFFAOYSA-N
Molecular Weight 236.391 g/mol
SMILES c1(sc2ccccc2c1)SCCCCC
SPLASH splash10-014i-2920000000-cd10abbc52582a7aa2dc
Source of Spectrum AP-0-2171-0
Synonyms 1-Benzothien-2-yl pentyl sulfide 2-(n-pentylthio)benzo(b)thiophene 2-(pentylsulfanyl)-1-benzothiophene 2-(pentylthio)-1-benzothiophene 2-Pentylsulfanylbenzothiophene 2-Pentylsulfanyl-1-benzothiophene
Wiley ID 32093