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2-Propen-1-one, 1,3-bis(4,5-dimethoxy-2-nitrophenyl)-
SpectraBase Compound ID 7ghBCVYx4tD
InChI InChI=1S/C19H18N2O9/c1-27-16-7-11(13(20(23)24)9-18(16)29-3)5-6-15(22)12-8-17(28-2)19(30-4)10-14(12)21(25)26/h5-10H,1-4H3/b6-5+
InChIKey NEWICXFFFHOSQU-AATRIKPKSA-N
Mol Weight 418.36 g/mol
Molecular Formula C19H18N2O9
Exact Mass 418.10123 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JBOEjOfbPJZ
Name 2-Propen-1-one, 1,3-bis(4,5-dimethoxy-2-nitrophenyl)-
CAS Registry Number 76787-20-7
Comments Less than 3 mono-isotopic peaks
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Formula C19H18N2O9
InChI InChI=1S/C19H18N2O9/c1-27-16-7-11(13(20(23)24)9-18(16)29-3)5-6-15(22)12-8-17(28-2)19(30-4)10-14(12)21(25)26/h5-10H,1-4H3/b6-5+
InChIKey NEWICXFFFHOSQU-AATRIKPKSA-N
Molecular Weight 418.358 g/mol
SMILES c1(N(=O)=O)c(cc(c(c1)OC)OC)C(\C=C\c1c(N(=O)=O)cc(c(c1)OC)OC)=O
SPLASH splash10-0006-0900000000-0a56788cb86c664b362b
Source of Spectrum Y-17-1493-0
Synonyms (2E)-1,3-bis(4,5-dimethoxy-2-nitrophenyl)-2-propen-1-one 1-(4,5-Dimethoxy-2-nitrophenyl)-3-(4,5-dimethoxy-2-nitrophenyl)-2-propen-1-one
Wiley ID 1377040