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1-(but-3-yn-1-yl)-3-methyl-1,3-dihydro-2H-benzo[d] imidazole-2-thione
SpectraBase Compound ID BcPsWH8Pi23
InChI InChI=1S/C12H12N2S/c1-3-4-9-14-11-8-6-5-7-10(11)13(2)12(14)15/h1,5-8H,4,9H2,2H3
InChIKey BAPBKNYPBMRCMR-UHFFFAOYSA-N
Mol Weight 216.3 g/mol
Molecular Formula C12H12N2S
Exact Mass 216.07212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L9PQikWyPT1
Name 1-(but-3-yn-1-yl)-3-methyl-1,3-dihydro-2H-benzo[d] imidazole-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2S
InChI InChI=1S/C12H12N2S/c1-3-4-9-14-11-8-6-5-7-10(11)13(2)12(14)15/h1,5-8H,4,9H2,2H3
InChIKey BAPBKNYPBMRCMR-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201801166
Molecular Weight 216.302 g/mol
SMILES C(CC#C)N1C(N(c2c1cccc2)C)=S
SPLASH splash10-0159-0950000000-900c3b687bcfbb572ee5
Source of Spectrum ASC-360-4804-42
Synonyms 1-(but-3-yn-1-yl)-3-methyl-1,3-dihydro-2H-benzo[d]imidazole-2-thione
Wiley ID 1812256