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3,6-Dimethyl-1-benzothiophene
SpectraBase Compound ID DAu9VX8nysK
InChI InChI=1S/C10H10S/c1-7-3-4-9-8(2)6-11-10(9)5-7/h3-6H,1-2H3
InChIKey PMTCJOMGGOAEBB-UHFFFAOYSA-N
Mol Weight 162.25 g/mol
Molecular Formula C10H10S
Exact Mass 162.050321 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DQ2vup3UjXP
Name 3,6-Dimethyl-1-benzothiophene
CAS Registry Number 16587-50-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10S
InChI InChI=1S/C10H10S/c1-7-3-4-9-8(2)6-11-10(9)5-7/h3-6H,1-2H3
InChIKey PMTCJOMGGOAEBB-UHFFFAOYSA-N
Molecular Weight 162.250 g/mol
SMILES c12scc(c2ccc(c1)C)C
SPLASH splash10-03di-0900000000-b07ced535d34ebc6a0ee
Source of Spectrum LQ-1992-2147-0
Synonyms Benzo[b]thiophene, 3,6-dimethyl- 3,6-Dimethylbenzothiophene Benzothiophene, 3,6-dimethyl
Wiley ID 1158726