For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1H-3-Benzazepine-2-carboxylic acid, 2,3,4,5-tetrahydro-8-methoxy-4-oxo-, methyl ester
SpectraBase Compound ID BcpfBDw0oqn
InChI InChI=1S/C13H15NO4/c1-17-10-4-3-8-7-12(15)14-11(13(16)18-2)6-9(8)5-10/h3-5,11H,6-7H2,1-2H3,(H,14,15)
InChIKey QWXGDSIAAZSFDS-UHFFFAOYSA-N
Mol Weight 249.27 g/mol
Molecular Formula C13H15NO4
Exact Mass 249.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GT1qrLYI083
Name 1H-3-Benzazepine-2-carboxylic acid, 2,3,4,5-tetrahydro-8-methoxy-4-oxo-, methyl ester
Alternate Name(s) Methyl 8-methoxy-4-oxo-2,3,4,5-tetrahydro-1H-3-benzazepine-2-carboxylate 4-keto-8-methoxy-1,2,3,5-tetrahydro-3-benzazepine-2-carboxylic acid methyl ester 8-Methoxy-4-oxo-1,2,3,5-tetrahydro-3-benzazepine-2-carboxylic acid methyl ester Methyl 8-methoxy-4-oxidanylidene-1,2,3,5-tetrahydro-3-benzazepine-2-carboxylate Methyl 8-methoxy-4-oxo-1,2,3,5-tetrahydro-3-benzazepine-2-carboxylate
CAS Registry Number 17639-49-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO4
InChI InChI=1S/C13H15NO4/c1-17-10-4-3-8-7-12(15)14-11(13(16)18-2)6-9(8)5-10/h3-5,11H,6-7H2,1-2H3,(H,14,15)
InChIKey QWXGDSIAAZSFDS-UHFFFAOYSA-N
Molecular Weight 249.266 g/mol
SMILES N1C(Cc2ccc(cc2CC1C(=O)OC)OC)=O
SPLASH splash10-01ot-0930000000-cbc7ca77af92c7fec9b0
Source of Spectrum C-90-778-2
Wiley ID 34820