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1-(3-Methylbutyl)-1H-1,3-benzodiazole-2-thiol

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1-(3-Methylbutyl)-1H-1,3-benzodiazole-2-thiol
SpectraBase Compound ID 2s4uoP9pFyL
InChI InChI=1S/C12H16N2S/c1-9(2)7-8-14-11-6-4-3-5-10(11)13-12(14)15/h3-6,9H,7-8H2,1-2H3,(H,13,15)
InChIKey VMUBBILWOSMHDZ-UHFFFAOYSA-N
Mol Weight 220.33 g/mol
Molecular Formula C12H16N2S
Exact Mass 220.10342 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0e26R3SzEu
Name 1-(3-Methylbutyl)-1H-1,3-benzodiazole-2-thiol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16N2S
InChI InChI=1S/C12H16N2S/c1-9(2)7-8-14-11-6-4-3-5-10(11)13-12(14)15/h3-6,9H,7-8H2,1-2H3,(H,13,15)
InChIKey VMUBBILWOSMHDZ-UHFFFAOYSA-N
Molecular Weight 220.334 g/mol
SMILES Sc1[n](c2c(cccc2)n1)CCC(C)C
SPLASH splash10-0gw0-4910000000-c957ce5de0c9adb07108
Source of Spectrum IY-2-4914-1
Synonyms 1H-1,3-Benzimidazole-2-thiol, 1-(3-methylbutyl)- 3-isopentyl-1H-benzimidazole-2-thione 3-(3-Methylbutyl)-1H-benzimidazole-2-thione
Wiley ID 1657124