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3-(4-Methoxyphenyl)-5-oxo-4,5-diphenylpentanoic acid ethyl ester
SpectraBase Compound ID 3FJKBut01a5
InChI InChI=1S/C26H26O4/c1-3-30-24(27)18-23(19-14-16-22(29-2)17-15-19)25(20-10-6-4-7-11-20)26(28)21-12-8-5-9-13-21/h4-17,23,25H,3,18H2,1-2H3
InChIKey XRAXKTJWDVIDBB-UHFFFAOYSA-N
Mol Weight 402.49 g/mol
Molecular Formula C26H26O4
Exact Mass 402.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 42crV482tm3
Name 3-(4-Methoxyphenyl)-5-oxo-4,5-diphenylpentanoic acid ethyl ester
Alternate Name(s) 5-keto-3-(4-methoxyphenyl)-4,5-diphenyl-valeric acid ethyl ester Ethyl 3-(4-methoxyphenyl)-5-oxidanylidene-4,5-diphenyl-pentanoate Ethyl 3-(4-methoxyphenyl)-5-oxo-4,5-diphenyl-pentanoate
CAS Registry Number 85503-30-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H26O4
InChI InChI=1S/C26H26O4/c1-3-30-24(27)18-23(19-14-16-22(29-2)17-15-19)25(20-10-6-4-7-11-20)26(28)21-12-8-5-9-13-21/h4-17,23,25H,3,18H2,1-2H3
InChIKey XRAXKTJWDVIDBB-UHFFFAOYSA-N
Molecular Weight 402.490 g/mol
SMILES C(C(C(=O)c1ccccc1)c1ccccc1)(CC(=O)OCC)c1ccc(cc1)OC
SPLASH splash10-0aor-2940000000-9907512a50c3a118fdfd
Source of Spectrum Y-19-1333-0
Wiley ID 1370597