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7-Methoxy-1,4,5-trimethyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepine-2-thione
SpectraBase Compound ID A6uiHZqtAup
InChI InChI=1S/C13H18N2OS/c1-9-7-13(17)15(3)11-6-5-10(16-4)8-12(11)14(9)2/h5-6,8-9H,7H2,1-4H3
InChIKey CVEMMVRISUWOIL-UHFFFAOYSA-N
Mol Weight 250.36 g/mol
Molecular Formula C13H18N2OS
Exact Mass 250.113984 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1N1SYNNMa7d
Name 1,4,5-Trimethyl-7-methoxy-1,3,4,5-tetrahydro-2H-1,5-benzodiazepine-2-thione
Alternate Name(s) 7-Methoxy-1,4,5-trimethyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepine-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18N2OS
InChI InChI=1S/C13H18N2OS/c1-9-7-13(17)15(3)11-6-5-10(16-4)8-12(11)14(9)2/h5-6,8-9H,7H2,1-4H3
InChIKey CVEMMVRISUWOIL-UHFFFAOYSA-N
Molecular Weight 250.360 g/mol
SMILES C1(N(c2c(N(C(C1)C)C)cc(cc2)OC)C)=S
SPLASH splash10-0ufr-0490000000-4dda53c776dd929262de
Source of Spectrum U-1996-132-4
Wiley ID 767890