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5-Methylbenzo[e]benzothiophene
SpectraBase Compound ID 8NOmyKWmhEV
InChI InChI=1S/C13H10S/c1-9-8-13-12(6-7-14-13)11-5-3-2-4-10(9)11/h2-8H,1H3
InChIKey POXQFGLAZGCSQP-UHFFFAOYSA-N
Mol Weight 198.28 g/mol
Molecular Formula C13H10S
Exact Mass 198.050321 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Aj1m9agr80b
Name 5-Methylbenzo[e]benzothiophene
CAS Registry Number 86474-77-3
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10S
InChI InChI=1S/C13H10S/c1-9-8-13-12(6-7-14-13)11-5-3-2-4-10(9)11/h2-8H,1H3
InChIKey POXQFGLAZGCSQP-UHFFFAOYSA-N
Molecular Weight 198.283 g/mol
SMILES c12c(scc2)cc(c2c1cccc2)C
SPLASH splash10-0002-0900000000-4d234825a10aca58c47c
Source of Spectrum Y-20-489-0
Synonyms 5-methylbenzo[e][1]benzothiole 5-Methylnaphtho[2,1-b]thiophene
Wiley ID 1196094