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2-Pentenoic acid, 5-(4-methoxyphenyl)-4,4-dimethyl-5-oxo-, methyl ester, (E)-
SpectraBase Compound ID 6c4Hiqk0R9L
InChI InChI=1S/C15H18O4/c1-15(2,10-9-13(16)19-4)14(17)11-5-7-12(18-3)8-6-11/h5-10H,1-4H3/b10-9+
InChIKey UEKJEFOXAYDJEX-MDZDMXLPSA-N
Mol Weight 262.3 g/mol
Molecular Formula C15H18O4
Exact Mass 262.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7KQcyqyO0mk
Name 2-Pentenoic acid, 5-(4-methoxyphenyl)-4,4-dimethyl-5-oxo-, methyl ester, (E)-
CAS Registry Number 128747-01-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O4
InChI InChI=1S/C15H18O4/c1-15(2,10-9-13(16)19-4)14(17)11-5-7-12(18-3)8-6-11/h5-10H,1-4H3/b10-9+
InChIKey UEKJEFOXAYDJEX-MDZDMXLPSA-N
Molecular Weight 262.305 g/mol
SMILES C(C(\C=C\C(=O)OC)(C)C)(c1ccc(cc1)OC)=O
SPLASH splash10-000i-1900000000-764b5d013beec18c0a81
Source of Spectrum F-46-1277-15
Synonyms Methyl (2E)-5-(4-methoxyphenyl)-4,4-dimethyl-5-oxo-2-pentenoate Methyl 4-(4-methoxybenzoyl)-4-methyl-pent-2-enoate
Wiley ID 1265861