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2-[1-(3,4,5-Trimethoxy-phenyl)-meth-(Z)-ylidene]-3-[1-(3,4,5-trimethoxy-phenyl)-meth-(E)-ylidene]-succinic acid 1-ethyl ester 4-(methoxycarbonyl-phenyl-methyl) ester
SpectraBase Compound ID FmTqaRMKmw4
InChI InChI=1S/C35H38O12/c1-9-46-33(36)24(15-21-17-26(39-2)31(43-6)27(18-21)40-3)25(16-22-19-28(41-4)32(44-7)29(20-22)42-5)34(37)47-30(35(38)45-8)23-13-11-10-12-14-23/h10-20,30H,9H2,1-8H3/b24-15-,25-16+
InChIKey AUGAIJMQCWDHSW-QTCLYGBFSA-N
Mol Weight 650.7 g/mol
Molecular Formula C35H38O12
Exact Mass 650.236327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2g2mNo4u02q
Name 2-[1-(3,4,5-Trimethoxy-phenyl)-meth-(Z)-ylidene]-3-[1-(3,4,5-trimethoxy-phenyl)-meth-(E)-ylidene]-succinic acid 1-ethyl ester 4-(methoxycarbonyl-phenyl-methyl) ester
Alternate Name(s) 2-Ethyl 3-(2-methoxy-2-oxo-1-phenylethyl) (1Z,3E)-1,4-bis(3,4,5-trimethoxyphenyl)-1,3-butadiene-2,3-dicarboxylate Ethyl Methylmandelyl (E,E)-Dibenzylidenesuccinate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H38O12
InChI InChI=1S/C35H38O12/c1-9-46-33(36)24(15-21-17-26(39-2)31(43-6)27(18-21)40-3)25(16-22-19-28(41-4)32(44-7)29(20-22)42-5)34(37)47-30(35(38)45-8)23-13-11-10-12-14-23/h10-20,30H,9H2,1-8H3/b24-15-,25-16+
InChIKey AUGAIJMQCWDHSW-QTCLYGBFSA-N
Molecular Weight 650.677 g/mol
SMILES c1(\C=C\(\C(C(OC(C(=O)OC)c2ccccc2)=O)=C/c2cc(OC)c(c(c2)OC)OC)C(=O)OCC)cc(OC)c(c(c1)OC)OC
SPLASH splash10-000w-3900110000-1b154193ec6a150feb31
Source of Spectrum F-69-4143-6
Wiley ID 1595206