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Propanedioic acid, [4-(1,3-benzodioxol-5-yl)-1,3-butadienyl]methyl-, dimethyl ester, (E,Z)-
SpectraBase Compound ID GWSlsATjfbk
InChI InChI=1S/C17H18O6/c1-17(15(18)20-2,16(19)21-3)9-5-4-6-12-7-8-13-14(10-12)23-11-22-13/h4-10H,11H2,1-3H3/b6-4-,9-5-
InChIKey WNDLZRGSFTWNNT-QQCDKKIISA-N
Mol Weight 318.33 g/mol
Molecular Formula C17H18O6
Exact Mass 318.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2tIzKr45Vqk
Name Propanedioic acid, [4-(1,3-benzodioxol-5-yl)-1,3-butadienyl]methyl-, dimethyl ester, (E,Z)-
Alternate Name(s) 1-[3,4-(methylenedioxy)phenyl]-5,5-dicarbomethoxy-1,3-hexadiene Dimethyl 2-[(1Z,3Z)-4-(1,3-benzodioxol-5-yl)-1,3-butadienyl]-2-methylmalonate
CAS Registry Number 93184-98-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O6
InChI InChI=1S/C17H18O6/c1-17(15(18)20-2,16(19)21-3)9-5-4-6-12-7-8-13-14(10-12)23-11-22-13/h4-10H,11H2,1-3H3/b6-4-,9-5-
InChIKey WNDLZRGSFTWNNT-QQCDKKIISA-N
Molecular Weight 318.325 g/mol
SMILES C(C(=O)OC)(C(=O)OC)(\C=C/C=C\c1cc2OCOc2cc1)C
SPLASH splash10-0lmi-0933000000-3336ae64a94906f5713f
Source of Spectrum J-49-4815-0
Wiley ID 1318386