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3-(tert-Butoxycarbonyl)-4,5-trimethylene-4,5-dihydroimidazo[1,5-a]benzo[f][1,4]diazepin-6-one
SpectraBase Compound ID JEkOEpC3xkk
InChI InChI=1S/C19H21N3O3/c1-19(2,3)25-18(24)15-16-14-9-6-10-21(14)17(23)12-7-4-5-8-13(12)22(16)11-20-15/h4-5,7-8,11,14H,6,9-10H2,1-3H3
InChIKey XUGRVOBSFJVQIV-UHFFFAOYSA-N
Mol Weight 339.4 g/mol
Molecular Formula C19H21N3O3
Exact Mass 339.158292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JfQnzD6zVcO
Name 3-(tert-Butoxycarbonyl)-4,5-trimethylene-4,5-dihydroimidazo[1,5-a]benzo[f][1,4]diazepin-6-one
Alternate Name(s) tert-Butyl 9-oxo-11,12,13,13a-tetrahydro-9H-imidazo[1,5-a]pyrrolo[2,1-c][1,4]benzodiazepine-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21N3O3
InChI InChI=1S/C19H21N3O3/c1-19(2,3)25-18(24)15-16-14-9-6-10-21(14)17(23)12-7-4-5-8-13(12)22(16)11-20-15/h4-5,7-8,11,14H,6,9-10H2,1-3H3
InChIKey XUGRVOBSFJVQIV-UHFFFAOYSA-N
Molecular Weight 339.395 g/mol
SMILES c12[n](cnc2C(OC(C)(C)C)=O)-c2c(cccc2)C(N2C1CCC2)=O
SPLASH splash10-000i-0190000000-63f945063528a3a8b9bb
Source of Spectrum O-26-638-27
Wiley ID 1334512