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Benzo[b]thiophene, 2-propyl-
SpectraBase Compound ID 2s3WXVM1TbI
InChI InChI=1S/C11H12S/c1-2-5-10-8-9-6-3-4-7-11(9)12-10/h3-4,6-8H,2,5H2,1H3
InChIKey IBJARYHUXSJWRZ-UHFFFAOYSA-N
Mol Weight 176.28 g/mol
Molecular Formula C11H12S
Exact Mass 176.065972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 65GRwp2w1iU
Name Benzo[b]thiophene, 2-propyl-
CAS Registry Number 16587-32-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12S
InChI InChI=1S/C11H12S/c1-2-5-10-8-9-6-3-4-7-11(9)12-10/h3-4,6-8H,2,5H2,1H3
InChIKey IBJARYHUXSJWRZ-UHFFFAOYSA-N
Molecular Weight 176.277 g/mol
SMILES c12c(cc(s2)CCC)cccc1
SPLASH splash10-0002-0900000000-24ef90fada1f0134fc05
Source of Spectrum JX-2015-6-9397
Synonyms 2-Propyl-1-benzothiophene 2-nor-propylbenzo(b)thiophene 2-Propylbenzothiophene Benzothiophene, 2-propyl 2-nor-propyl-1-thiaindene 2-Propylbenzo[b]thiophene
Wiley ID 1730275