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2-[(E,1S)-1,3-diphenylallyl]malonic acid dimethyl ester
SpectraBase Compound ID LetpbyFhwNF
InChI InChI=1S/C20H20O4/c1-23-19(21)18(20(22)24-2)17(16-11-7-4-8-12-16)14-13-15-9-5-3-6-10-15/h3-14,17-18H,1-2H3/b14-13+/t17-/m1/s1
InChIKey RTUIHIVPYZLWPB-TUQDCPSNSA-N
Mol Weight 324.38 g/mol
Molecular Formula C20H20O4
Exact Mass 324.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BN8JdaZ6Ihx
Name 2-[(E,1S)-1,3-diphenylallyl]malonic acid dimethyl ester
Alternate Name(s) 2-[(E,1S)-1,3-diphenylprop-2-enyl]propanedioic acid dimethyl ester Dimethyl 2-[(E,1S)-1,3-diphenylallyl]propanedioate Dimethyl 2-[(E,1S)-1,3-diphenylprop-2-enyl]propanedioate
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Formula C20H20O4
InChI InChI=1S/C20H20O4/c1-23-19(21)18(20(22)24-2)17(16-11-7-4-8-12-16)14-13-15-9-5-3-6-10-15/h3-14,17-18H,1-2H3/b14-13+/t17-/m1/s1
InChIKey RTUIHIVPYZLWPB-TUQDCPSNSA-N
Molecular Weight 324.376 g/mol
SMILES C([C@](\C=C\c1ccccc1)(c1ccccc1)[H])(C(=O)OC)C(=O)OC
SPLASH splash10-066u-0930000000-fffac9810ec5bfa36477
Source of Spectrum QE-12-3607-12
Wiley ID 1586945