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4H-1-Benzopyran-4-one, 5-(acetyloxy)-3-(2,4-dinitrophenyl)-6,7-dimethoxy-2-methyl-
SpectraBase Compound ID CtiN2ZTB8gI
InChI InChI=1S/C20H16N2O10/c1-9-16(12-6-5-11(21(25)26)7-13(12)22(27)28)18(24)17-14(31-9)8-15(29-3)19(30-4)20(17)32-10(2)23/h5-8H,1-4H3
InChIKey ZHHGFWRLYCGOKV-UHFFFAOYSA-N
Mol Weight 444.35 g/mol
Molecular Formula C20H16N2O10
Exact Mass 444.080495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K6QrNRavoO0
Name 4H-1-Benzopyran-4-one, 5-(acetyloxy)-3-(2,4-dinitrophenyl)-6,7-dimethoxy-2-methyl-
CAS Registry Number 62995-15-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16N2O10
InChI InChI=1S/C20H16N2O10/c1-9-16(12-6-5-11(21(25)26)7-13(12)22(27)28)18(24)17-14(31-9)8-15(29-3)19(30-4)20(17)32-10(2)23/h5-8H,1-4H3
InChIKey ZHHGFWRLYCGOKV-UHFFFAOYSA-N
Molecular Weight 444.352 g/mol
SMILES C=1(C(c2c(c(OC)c(cc2OC1C)OC)OC(=O)C)=O)c1c(N(=O)=O)cc(N(=O)=O)cc1
SPLASH splash10-0udi-0005900000-82cb709b85bf4c61c2d2
Source of Spectrum KC-1977-436-0
Synonyms 2-Methyl-6,7-dimethoxy -5-acetoxy-3-(2,4-dinitrophenyl)chromone 3-(2,4-dinitrophenyl)-6,7-dimethoxy-2-methyl-4-oxo-4H-chromen-5-yl acetate
Wiley ID 1385878