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3H-2,3-Benzodiazepine-3,8-dicarboxylic acid, 3-ethyl 8-methyl ester
SpectraBase Compound ID ACijh2bFN1V
InChI InChI=1S/C14H14N2O4/c1-3-20-14(18)16-7-6-10-4-5-11(13(17)19-2)8-12(10)9-15-16/h4-9H,3H2,1-2H3
InChIKey TVRPRTRZWHTKJM-UHFFFAOYSA-N
Mol Weight 274.28 g/mol
Molecular Formula C14H14N2O4
Exact Mass 274.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8BV3pBChtQ3
Name 3H-2,3-Benzodiazepine-3,8-dicarboxylic acid, 3-ethyl 8-methyl ester
CAS Registry Number 70266-29-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O4
InChI InChI=1S/C14H14N2O4/c1-3-20-14(18)16-7-6-10-4-5-11(13(17)19-2)8-12(10)9-15-16/h4-9H,3H2,1-2H3
InChIKey TVRPRTRZWHTKJM-UHFFFAOYSA-N
Molecular Weight 274.276 g/mol
SMILES C1=NN(C=Cc2ccc(cc12)C(=O)OC)C(=O)OCC
SPLASH splash10-0fk9-0390000000-080479dd27247b0f98ba
Source of Spectrum AJ-57-3486-12
Synonyms 3-O-ethyl 8-O-methyl 2,3-benzodiazepine-3,8-dicarboxylate O3-ethyl O8-methyl 2,3-benzodiazepine-3,8-dicarboxylate
Wiley ID 1277949