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N-[alpha-(2-oxo-2H-1-benzopyran-3-yl)benzyl)malonamic acid, ethyl ester
SpectraBase Compound ID Lph0UZpZ18j
InChI InChI=1S/C21H19NO5/c1-2-26-19(24)13-18(23)22-20(14-8-4-3-5-9-14)16-12-15-10-6-7-11-17(15)27-21(16)25/h3-12,20H,2,13H2,1H3,(H,22,23)
InChIKey NCBGIQFANLMTKM-UHFFFAOYSA-N
Mol Weight 365.39 g/mol
Molecular Formula C21H19NO5
Exact Mass 365.126323 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID E9qEgS0YWy9
Name N-[alpha-(2-OXO-2H-1-BENZOPYRAN-3-YL)BENZYL]MALONAMIC ACID, ETHYL ESTER
Source of Sample A. Bojilova and C. Ivanov, University of Sofia, Sofia, Bulgaria
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19NO5
InChI InChI=1S/C21H19NO5/c1-2-26-19(24)13-18(23)22-20(14-8-4-3-5-9-14)16-12-15-10-6-7-11-17(15)27-21(16)25/h3-12,20H,2,13H2,1H3,(H,22,23)
InChIKey NCBGIQFANLMTKM-UHFFFAOYSA-N
Literature Reference SYNTHESIS 1984, 489
Melting Point 124-126C
Molecular Weight 365.385010
Synonyms MALONAMIC ACID, N-/A-/2-OXO- 2H-1-BENZOPYRAN-3-YL/BENZYL/-, ETHYL ESTER
Technique KBr WAFER