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1,3-Dioxane-4,6-dione, 5-[[[2,3-dimethoxy-5-(2-nitroethyl)phenyl]amino]methylene]-2,2-dimethyl-
SpectraBase Compound ID 9d6dlhd8OcF
InChI InChI=1S/C17H20N2O8/c1-17(2)26-15(20)11(16(21)27-17)9-18-12-7-10(5-6-19(22)23)8-13(24-3)14(12)25-4/h7-9,18H,5-6H2,1-4H3
InChIKey ATYATBRLSRLFKY-UHFFFAOYSA-N
Mol Weight 380.35 g/mol
Molecular Formula C17H20N2O8
Exact Mass 380.121966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LNds2UNr0vy
Name 1,3-Dioxane-4,6-dione, 5-[[[2,3-dimethoxy-5-(2-nitroethyl)phenyl]amino]methylene]-2,2-dimethyl-
CAS Registry Number 114574-57-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20N2O8
InChI InChI=1S/C17H20N2O8/c1-17(2)26-15(20)11(16(21)27-17)9-18-12-7-10(5-6-19(22)23)8-13(24-3)14(12)25-4/h7-9,18H,5-6H2,1-4H3
InChIKey ATYATBRLSRLFKY-UHFFFAOYSA-N
Molecular Weight 380.353 g/mol
SMILES N(c1c(c(OC)cc(c1)CCN(=O)=O)OC)C=C1C(OC(OC1=O)(C)C)=O
SPLASH splash10-001j-0092000000-dbee9bf82c38a43d7702
Source of Spectrum F-43-4809-8
Synonyms 5-[2,3-dimethoxy-5-(2-nitroethyl)phenylaminomethylene]-2,2-dimethyl-1,3-dioxane-4,6-dione 5-{[2,3-dimethoxy-5-(2-nitroethyl)anilino]methylene}-2,2-dimethyl-1,3-dioxane-4,6-dione
Wiley ID 1359535