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3,5-Methano-1H-2-benzazepin-1-one, 2,3,4,5-tetrahydro-8-nitro-
SpectraBase Compound ID 8yhmxbARmuV
InChI InChI=1S/C11H10N2O3/c14-11-10-5-8(13(15)16)1-2-9(10)6-3-7(4-6)12-11/h1-2,5-7H,3-4H2,(H,12,14)
InChIKey BJYXILSRGPYWJH-UHFFFAOYSA-N
Mol Weight 218.21 g/mol
Molecular Formula C11H10N2O3
Exact Mass 218.069142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dm6Aj48qVLZ
Name 3,5-Methano-1H-2-benzazepin-1-one, 2,3,4,5-tetrahydro-8-nitro-
Alternate Name(s) 5-Nitro-9-azatricyclo[8.1.1.0(2,7)]dodeca-2,4,6-trien-8-one 8-Nitro-3,5-methano-2,3,4,5-tetrahydro-1H-1-benzazepine-2-one
CAS Registry Number 94641-49-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10N2O3
InChI InChI=1S/C11H10N2O3/c14-11-10-5-8(13(15)16)1-2-9(10)6-3-7(4-6)12-11/h1-2,5-7H,3-4H2,(H,12,14)
InChIKey BJYXILSRGPYWJH-UHFFFAOYSA-N
Molecular Weight 218.212 g/mol
SMILES N1C2CC(c3c(C1=O)cc(cc3)N(=O)=O)C2
SPLASH splash10-004u-0900000000-4e93ff6bd18af8db0734
Source of Spectrum O-21-379-4
Wiley ID 1217338