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12-Methyl-1,2,4-triazolo[4,3-a](3,4)(5,6)-dibenz-7H-azepine-3[2H]-thione

View entire compound with spectra: 1 MS (GC)

12-Methyl-1,2,4-triazolo[4,3-a](3,4)(5,6)-dibenz-7H-azepine-3[2H]-thione
SpectraBase Compound ID Bs3kMygkRtP
InChI InChI=1S/C16H13N3S/c1-10-6-7-13-12-5-3-2-4-11(12)9-19-15(14(13)8-10)17-18-16(19)20/h2-8H,9H2,1H3,(H,18,20)
InChIKey BLCCWVQYTNVWOK-UHFFFAOYSA-N
Mol Weight 279.36 g/mol
Molecular Formula C16H13N3S
Exact Mass 279.083019 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 63LIU3OQVsa
Name 12-Methyl-1,2,4-triazolo[4,3-a](3,4)(5,6)-dibenz-7H-azepine-3[2H]-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13N3S
InChI InChI=1S/C16H13N3S/c1-10-6-7-13-12-5-3-2-4-11(12)9-19-15(14(13)8-10)17-18-16(19)20/h2-8H,9H2,1H3,(H,18,20)
InChIKey BLCCWVQYTNVWOK-UHFFFAOYSA-N
Molecular Weight 279.361 g/mol
SMILES N1N=C2N(C1=S)Cc1c(-c3c2cc(cc3)C)cccc1
SPLASH splash10-004i-1290000000-68a9537f00c859fa222a
Source of Spectrum F4-0-3846-9
Wiley ID 1621058