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3-(4-Methylphenyl)-3-[[oxo-(2-oxo-1-benzopyran-3-yl)methyl]amino]propanoic acid ethyl ester
SpectraBase Compound ID F5K6lurbGZL
InChI InChI=1S/C22H21NO5/c1-3-27-20(24)13-18(15-10-8-14(2)9-11-15)23-21(25)17-12-16-6-4-5-7-19(16)28-22(17)26/h4-12,18H,3,13H2,1-2H3,(H,23,25)
InChIKey ANMSNPMTPBCBGR-UHFFFAOYSA-N
Mol Weight 379.41 g/mol
Molecular Formula C22H21NO5
Exact Mass 379.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L3m6q1DgPmj
Name 3-(4-Methylphenyl)-3-[[oxo-(2-oxo-1-benzopyran-3-yl)methyl]amino]propanoic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21NO5
InChI InChI=1S/C22H21NO5/c1-3-27-20(24)13-18(15-10-8-14(2)9-11-15)23-21(25)17-12-16-6-4-5-7-19(16)28-22(17)26/h4-12,18H,3,13H2,1-2H3,(H,23,25)
InChIKey ANMSNPMTPBCBGR-UHFFFAOYSA-N
Molecular Weight 379.412 g/mol
SMILES N(C(C=1C(Oc2c(C1)cccc2)=O)=O)C(CC(=O)OCC)c1ccc(cc1)C
SPLASH splash10-0ab9-2960000000-1400acb2b570062790e2
Synonyms 3-[(2-ketochromene-3-carbonyl)amino]-3-(p-tolyl)propionic acid ethyl ester Ethyl 3-(4-methylphenyl)-3-[(2-oxidanylidenechromen-3-yl)carbonylamino]propanoate Ethyl 3-(4-methylphenyl)-3-[(2-oxochromene-3-carbonyl)amino]propanoate Ethyl 3-(4-methylphenyl)-3-{[(2-oxo-2H-chromen-3-yl)carbonyl]amino}propanoate Ethyl 3-[(2-oxochromene-3-carbonyl)amino]-3-(p-tolyl)propanoate
Wiley ID 1442147