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Pentanedioic acid, 3-cyano-2,4-bis(2-methyl-1-propenyl)-3-phenyl-, dimethyl ester

View entire compound with spectra: 1 MS (GC)

Pentanedioic acid, 3-cyano-2,4-bis(2-methyl-1-propenyl)-3-phenyl-, dimethyl ester
SpectraBase Compound ID EBAHC7DjBgG
InChI InChI=1S/C22H27NO4/c1-15(2)12-18(20(24)26-5)22(14-23,17-10-8-7-9-11-17)19(13-16(3)4)21(25)27-6/h7-13,18-19H,1-6H3
InChIKey FFVMTJNVIMIVEJ-UHFFFAOYSA-N
Mol Weight 369.46 g/mol
Molecular Formula C22H27NO4
Exact Mass 369.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EBt6HouMIuJ
Name Pentanedioic acid, 3-cyano-2,4-bis(2-methyl-1-propenyl)-3-phenyl-, dimethyl ester
Alternate Name(s) 50cyano-4,6-dimethoxycarbonyl-2,8-dimethyl-5-phenyl-nona-2,7 diene Dimethyl 3-cyano-2,4-bis(2-methyl-1-propenyl)-3-phenylpentanedioate
CAS Registry Number 118089-30-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27NO4
InChI InChI=1S/C22H27NO4/c1-15(2)12-18(20(24)26-5)22(14-23,17-10-8-7-9-11-17)19(13-16(3)4)21(25)27-6/h7-13,18-19H,1-6H3
InChIKey FFVMTJNVIMIVEJ-UHFFFAOYSA-N
Molecular Weight 369.461 g/mol
SMILES C(C(C=C(C)C)C(=O)OC)(C(C=C(C)C)C(=O)OC)(C#N)c1ccccc1
SPLASH splash10-000i-0309000000-f1439f9649cdaabb19be
Source of Spectrum F-46-1276-12
Wiley ID 1353770