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(6aS)-2,3-dimethoxy-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione
SpectraBase Compound ID JQhZ90N32bB
InChI InChI=1S/C14H16N2O4/c1-19-11-6-8-9(7-12(11)20-2)15-13(17)10-4-3-5-16(10)14(8)18/h6-7,10H,3-5H2,1-2H3,(H,15,17)/t10-/m0/s1
InChIKey OTPXJHDUEWRZTQ-JTQLQIEISA-N
Mol Weight 276.29 g/mol
Molecular Formula C14H16N2O4
Exact Mass 276.111007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CfJXCex1X6h
Name (6aS)-2,3-dimethoxy-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione
Alternate Name(s) (6aS)-2,3-dimethoxy-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N2O4
InChI InChI=1S/C14H16N2O4/c1-19-11-6-8-9(7-12(11)20-2)15-13(17)10-4-3-5-16(10)14(8)18/h6-7,10H,3-5H2,1-2H3,(H,15,17)/t10-/m0/s1
InChIKey OTPXJHDUEWRZTQ-JTQLQIEISA-N
Molecular Weight 276.292 g/mol
SMILES N1c2c(C(N3[C@](C1=O)(CCC3)[H])=O)cc(c(c2)OC)OC
SPLASH splash10-00fr-7970000000-e8b7b56b86015d35301e
Source of Spectrum F-70-2262-11
Wiley ID 1596502