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1,4-Dimethyl-7-hydroxy-1,3,4,5-tetrahydro-2H-1,5-benzodiazepine-2-thione

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1,4-Dimethyl-7-hydroxy-1,3,4,5-tetrahydro-2H-1,5-benzodiazepine-2-thione
SpectraBase Compound ID 4UsLiACkmIQ
InChI InChI=1S/C11H14N2OS/c1-7-5-11(15)13(2)10-4-3-8(14)6-9(10)12-7/h3-4,6-7,12,14H,5H2,1-2H3
InChIKey OBRREJLSWWVMAT-UHFFFAOYSA-N
Mol Weight 222.31 g/mol
Molecular Formula C11H14N2OS
Exact Mass 222.082684 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3JIh6VxEtRt
Name 1,4-Dimethyl-7-hydroxy-1,3,4,5-tetrahydro-2H-1,5-benzodiazepine-2-thione
Alternate Name(s) 7-Hydroxy-1,4-dimethyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepine-2-thione 1,4-Dimethyl-7-oxidanyl-4,5-dihydro-3H-1,5-benzodiazepine-2-thione
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Formula C11H14N2OS
InChI InChI=1S/C11H14N2OS/c1-7-5-11(15)13(2)10-4-3-8(14)6-9(10)12-7/h3-4,6-7,12,14H,5H2,1-2H3
InChIKey OBRREJLSWWVMAT-UHFFFAOYSA-N
Molecular Weight 222.306 g/mol
SMILES N1c2cc(ccc2N(C(CC1C)=S)C)O
SPLASH splash10-00dj-0960000000-522b2d50f97ce0b0eddf
Source of Spectrum U-1996-131-3
Wiley ID 767895