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2-Butyl-3-phenylbenzo[b]thiophene
SpectraBase Compound ID IxdDFbuVZFo
InChI InChI=1S/C18H18S/c1-2-3-12-17-18(14-9-5-4-6-10-14)15-11-7-8-13-16(15)19-17/h4-11,13H,2-3,12H2,1H3
InChIKey MDJFFPXGURHTGA-UHFFFAOYSA-N
Mol Weight 266.4 g/mol
Molecular Formula C18H18S
Exact Mass 266.112922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BD4j5xAf3QF
Name 2-Butyl-3-phenylbenzo[b]thiophene
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18S
InChI InChI=1S/C18H18S/c1-2-3-12-17-18(14-9-5-4-6-10-14)15-11-7-8-13-16(15)19-17/h4-11,13H,2-3,12H2,1H3
InChIKey MDJFFPXGURHTGA-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202200353
Molecular Weight 266.402 g/mol
SMILES c1(c2c(sc1CCCC)cccc2)-c1ccccc1
SPLASH splash10-00di-0090000000-6aff69bd4f368fd884bc
Source of Spectrum AJO-11-12-6ic
Wiley ID 1873031