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7-Methylbenzo[e]benzothiophene

View entire compound with spectra: 1 MS (GC)

7-Methylbenzo[e]benzothiophene
SpectraBase Compound ID FcX5m2MdHER
InChI InChI=1S/C13H10S/c1-9-2-4-11-10(8-9)3-5-13-12(11)6-7-14-13/h2-8H,1H3
InChIKey SKDBEKIAJLSGPS-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 H8irg7rlKPo
Name 7-Methylbenzo[e]benzothiophene
CAS Registry Number 4567-39-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10S
InChI InChI=1S/C13H10S/c1-9-2-4-11-10(8-9)3-5-13-12(11)6-7-14-13/h2-8H,1H3
InChIKey SKDBEKIAJLSGPS-UHFFFAOYSA-N
Molecular Weight 198.283 g/mol
SMILES c12c3c(scc3)ccc1cc(cc2)C
SPLASH splash10-0002-0900000000-677d69f8d5851401e1a7
Source of Spectrum Y-20-489-0
Synonyms 7-methylbenzo[e][1]benzothiole 7-Methylnaphtho[2,1-b]thiophene
Wiley ID 1196096