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4H-[1]Benzopyrano[2,3-d]pyrimidine-2-carboxylic acid, 3,5-dihydro-4,5-dioxo-, ethyl ester
SpectraBase Compound ID 3jpzRWodCtD
InChI InChI=1S/C14H10N2O5/c1-2-20-14(19)11-15-12(18)9-10(17)7-5-3-4-6-8(7)21-13(9)16-11/h3-6H,2H2,1H3,(H,15,16,18)
InChIKey HMWJZWCZWHTCCM-UHFFFAOYSA-N
Mol Weight 286.24 g/mol
Molecular Formula C14H10N2O5
Exact Mass 286.058971 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1j9UwGuVJpr
Name 4H-[1]Benzopyrano[2,3-d]pyrimidine-2-carboxylic acid, 3,5-dihydro-4,5-dioxo-, ethyl ester
Alternate Name(s) ethyl 4,5-dioxo-3,5-dihydro-4H-chromeno[2,3-d]pyrimidine-2-carboxylate Ethyl 4,5-dioxo-3H-[1]benzopyrano[2,3-d]pyrimidine-2-carboxylate
CAS Registry Number 107691-08-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H10N2O5
InChI InChI=1S/C14H10N2O5/c1-2-20-14(19)11-15-12(18)9-10(17)7-5-3-4-6-8(7)21-13(9)16-11/h3-6H,2H2,1H3,(H,15,16,18)
InChIKey HMWJZWCZWHTCCM-UHFFFAOYSA-N
Molecular Weight 286.243 g/mol
SMILES N1C(C2=C(N=C1C(=O)OCC)Oc1c(C2=O)cccc1)=O
SPLASH splash10-03di-0090000000-d1792c5fb66b32efba57
Source of Spectrum KC-1986-1646-6
Wiley ID 1289506