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(Z)-3-[2-(.beta.-N-Ethoxycarbonyl-N-methylaminoethyl)-4,5-methylenedioxybenzylidene]-6,7-dimethoxy-1(3H)-isobenzofuranone isomer
SpectraBase Compound ID K71YGMy8zjS
InChI InChI=1S/C24H25NO8/c1-5-30-24(27)25(2)9-8-14-10-19-20(32-13-31-19)12-15(14)11-18-16-6-7-17(28-3)22(29-4)21(16)23(26)33-18/h6-7,10-12H,5,8-9,13H2,1-4H3/b18-11-
InChIKey OLZLQXUKCNJAGA-WQRHYEAKSA-N
Mol Weight 455.46 g/mol
Molecular Formula C24H25NO8
Exact Mass 455.158017 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JqUCZ3XHGQ6
Name (Z)-3-[2-(.beta.-N-Ethoxycarbonyl-N-methylaminoethyl)-4,5-methylenedioxybenzylidene]-6,7-dimethoxy-1(3H)-isobenzofuranone isomer
Alternate Name(s) Ethyl 2-{6-[(Z)-(4,5-dimethoxy-3-oxo-2-benzofuran-1(3H)-ylidene)methyl]-1,3-benzodioxol-5-yl}ethyl(methyl)carbamate
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Formula C24H25NO8
InChI InChI=1S/C24H25NO8/c1-5-30-24(27)25(2)9-8-14-10-19-20(32-13-31-19)12-15(14)11-18-16-6-7-17(28-3)22(29-4)21(16)23(26)33-18/h6-7,10-12H,5,8-9,13H2,1-4H3/b18-11-
InChIKey OLZLQXUKCNJAGA-WQRHYEAKSA-N
Molecular Weight 455.463 g/mol
SMILES c12C(O\C(c2ccc(c1OC)OC)=C\c1c(cc2c(c1)OCO2)CCN(C(=O)OCC)C)=O
SPLASH splash10-0ldi-0809400000-d12161476c5a9e9728f1
Source of Spectrum E1-39-1948-12
Wiley ID 1518923