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2-Hexylbenzo[b]thiophene

View entire compound with spectra: 1 MS (GC)

2-Hexylbenzo[b]thiophene
SpectraBase Compound ID DUbWUhdG5dJ
InChI InChI=1S/C14H18S/c1-2-3-4-5-9-13-11-12-8-6-7-10-14(12)15-13/h6-8,10-11H,2-5,9H2,1H3
InChIKey OFVOLJASNASQGE-UHFFFAOYSA-N
Mol Weight 218.36 g/mol
Molecular Formula C14H18S
Exact Mass 218.112922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2sSsTtUZIJf
Name 2-Hexylbenzo[b]thiophene
Alternate Name(s) 2-Hexyl-1-benzothiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18S
InChI InChI=1S/C14H18S/c1-2-3-4-5-9-13-11-12-8-6-7-10-14(12)15-13/h6-8,10-11H,2-5,9H2,1H3
InChIKey OFVOLJASNASQGE-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol201970m
Molecular Weight 218.358 g/mol
SMILES c1cc2cc(sc2cc1)CCCCCC
SPLASH splash10-0002-0910000000-72340c6523da0990672d
Source of Spectrum A1-13-5100/SMS14-3h
Wiley ID 1753727