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3-Methyl-1,3-dihydro-2H-1,3,4-benzotriazepine-2-thione
SpectraBase Compound ID 3l8dz4tdWwJ
InChI InChI=1S/C9H9N3S/c1-12-9(13)11-8-5-3-2-4-7(8)6-10-12/h2-6H,1H3,(H,11,13)
InChIKey JOBWGFBUAZNVKF-UHFFFAOYSA-N
Mol Weight 191.25 g/mol
Molecular Formula C9H9N3S
Exact Mass 191.051718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7hGKBhzgNMk
Name 3-Methyl-1,3-dihydro-2H-1,3,4-benzotriazepine-2-thione
CAS Registry Number 121361-81-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9N3S
InChI InChI=1S/C9H9N3S/c1-12-9(13)11-8-5-3-2-4-7(8)6-10-12/h2-6H,1H3,(H,11,13)
InChIKey JOBWGFBUAZNVKF-UHFFFAOYSA-N
Molecular Weight 191.252 g/mol
SMILES N1c2c(C=NN(C1=S)C)cccc2
SPLASH splash10-0006-0900000000-e4687c0a943882ab1ecb
Source of Spectrum Y-27-260-1
Synonyms 3-Methyl-2-thioxo-1,2-dihydro-3H-1,3,4-benzotriazepine
Wiley ID 1187374