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7-Chloro-3,5-dimethyl-1,3-dihydro-2H-1,3,4-benzotriazepine-2-thione
SpectraBase Compound ID LSuFkJoFzwl
InChI InChI=1S/C10H10ClN3S/c1-6-8-5-7(11)3-4-9(8)12-10(15)14(2)13-6/h3-5H,1-2H3,(H,12,15)
InChIKey OZPOLVLSVLVQRS-UHFFFAOYSA-N
Mol Weight 239.72 g/mol
Molecular Formula C10H10ClN3S
Exact Mass 239.028396 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9kQPu759xgG
Name 7-Chloro-3,5-dimethyl-1,3-dihydro-2H-1,3,4-benzotriazepine-2-thione
Alternate Name(s) 3H-1,3,4-Benzotriazepine, 7-chloro-1,2-dihydro-3,5-dimethyl-2-thioxo-
CAS Registry Number 105999-04-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10ClN3S
InChI InChI=1S/C10H10ClN3S/c1-6-8-5-7(11)3-4-9(8)12-10(15)14(2)13-6/h3-5H,1-2H3,(H,12,15)
InChIKey OZPOLVLSVLVQRS-UHFFFAOYSA-N
Molecular Weight 239.724 g/mol
SMILES SC1=Nc2ccc(cc2C(C)=NN1C)Cl
SPLASH splash10-052r-0590000000-4bf2d531ab8fb3fca899
Source of Spectrum Y-27-260-3
Wiley ID 1241712