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8-Methylthio-3-phenyl-1-azaazulene

View entire compound with spectra: 1 MS (GC)

8-Methylthio-3-phenyl-1-azaazulene
SpectraBase Compound ID 4lXsgrlP88G
InChI InChI=1S/C16H13NS/c1-18-15-10-6-5-9-13-14(11-17-16(13)15)12-7-3-2-4-8-12/h2-11H,1H3
InChIKey YFKGJLGTPWLUDZ-UHFFFAOYSA-N
Mol Weight 251.35 g/mol
Molecular Formula C16H13NS
Exact Mass 251.076871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IMaAr2Pma1O
Name 8-Methylthio-3-phenyl-1-azaazulene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13NS
InChI InChI=1S/C16H13NS/c1-18-15-10-6-5-9-13-14(11-17-16(13)15)12-7-3-2-4-8-12/h2-11H,1H3
InChIKey YFKGJLGTPWLUDZ-UHFFFAOYSA-N
Molecular Weight 251.347 g/mol
SMILES c12c(c(-c3ccccc3)cn1)ccccc2SC
SPLASH splash10-0udi-0390000000-1e3449efbc6d57c59141
Source of Spectrum O1-61-243-4
Synonyms 8-(methylsulfanyl)-3-phenylcyclohepta[b]pyrrole 8-Methylthia-3-phenyl-1-azaazulene Methyl 3-phenylcyclohepta[b]pyrrol-8-yl sulfide
Wiley ID 1592291