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Pentanedioic acid, 3-(1-oxo-3-phenyl-2-propenyl)-, diethyl ester
SpectraBase Compound ID 9vA4nNP4FMc
InChI InChI=1S/C18H22O5/c1-3-22-17(20)12-15(13-18(21)23-4-2)16(19)11-10-14-8-6-5-7-9-14/h5-11,15H,3-4,12-13H2,1-2H3/b11-10+
InChIKey RBOQMNGXUJJDCR-ZHACJKMWSA-N
Mol Weight 318.37 g/mol
Molecular Formula C18H22O5
Exact Mass 318.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EbCeJ1cUOoJ
Name Pentanedioic acid, 3-(1-oxo-3-phenyl-2-propenyl)-, diethyl ester
CAS Registry Number 67490-14-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O5
InChI InChI=1S/C18H22O5/c1-3-22-17(20)12-15(13-18(21)23-4-2)16(19)11-10-14-8-6-5-7-9-14/h5-11,15H,3-4,12-13H2,1-2H3/b11-10+
InChIKey RBOQMNGXUJJDCR-ZHACJKMWSA-N
Molecular Weight 318.369 g/mol
SMILES C(\C=C\c1ccccc1)(C(CC(=O)OCC)CC(=O)OCC)=O
SPLASH splash10-0006-0592000000-957b04da9111954ffa73
Source of Spectrum F-37-4538-0
Synonyms Diethyl 3-[(2E)-3-phenyl-2-propenoyl]pentanedioate Ethyl 3-carbethoxymethyl-5-benzylidenelevulinate
Wiley ID 1318510