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3,1-Benzoxazepine-4,5-dicarboxylic acid, 2-phenyl-, dimethyl ester
SpectraBase Compound ID FBE3dwHDvAU
InChI InChI=1S/C19H15NO5/c1-23-18(21)15-13-10-6-7-11-14(13)20-17(12-8-4-3-5-9-12)25-16(15)19(22)24-2/h3-11H,1-2H3
InChIKey ICVLAJBUPCLCPT-UHFFFAOYSA-N
Mol Weight 337.33 g/mol
Molecular Formula C19H15NO5
Exact Mass 337.095023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4CzP4aq5TD4
Name 3,1-Benzoxazepine-4,5-dicarboxylic acid, 2-phenyl-, dimethyl ester
Alternate Name(s) Dimethyl 2-phenyl-3,1-benzoxazepine-4,5-dicarboxylate
CAS Registry Number 88344-58-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15NO5
InChI InChI=1S/C19H15NO5/c1-23-18(21)15-13-10-6-7-11-14(13)20-17(12-8-4-3-5-9-12)25-16(15)19(22)24-2/h3-11H,1-2H3
InChIKey ICVLAJBUPCLCPT-UHFFFAOYSA-N
Molecular Weight 337.331 g/mol
SMILES C1(=C(OC(c2ccccc2)=Nc2c1cccc2)C(=O)OC)C(=O)OC
SPLASH splash10-0a4i-9042000000-5c7db525afd5877474ff
Source of Spectrum B-36-1429-0
Wiley ID 1333112