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4-[2',2'-Diamino-1'-(ethoxycarbonyl)ethenyl]-6-nitrochroman-2-one
SpectraBase Compound ID 80Sy1baqFAH
InChI InChI=1S/C14H15N3O6/c1-2-22-14(19)12(13(15)16)9-6-11(18)23-10-4-3-7(17(20)21)5-8(9)10/h3-5,9H,2,6,15-16H2,1H3
InChIKey QLRJPZPNOWUUMB-UHFFFAOYSA-N
Mol Weight 321.29 g/mol
Molecular Formula C14H15N3O6
Exact Mass 321.096085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BahB70LKdyL
Name 4-[2',2'-Diamino-1'-(ethoxycarbonyl)ethenyl]-6-nitrochroman-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15N3O6
InChI InChI=1S/C14H15N3O6/c1-2-22-14(19)12(13(15)16)9-6-11(18)23-10-4-3-7(17(20)21)5-8(9)10/h3-5,9H,2,6,15-16H2,1H3
InChIKey QLRJPZPNOWUUMB-UHFFFAOYSA-N
Molecular Weight 321.289 g/mol
SMILES NC(=C(C1c2c(ccc(N(=O)=O)c2)OC(C1)=O)C(=O)OCC)N
SPLASH splash10-0006-0900000000-145aaf4cf0d8bc92201e
Source of Spectrum D8-328-56-5
Synonyms Ethyl 3,3-diamino-2-(6-nitro-2-oxo-3,4-dihydro-2H-chromen-4-yl)acrylate
Wiley ID 1515574