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4,8-Decadienoic acid, 2-benzoyl-5,9-dimethyl-2-(3-oxo-1-butyl)-, ethyl ester, (E)-
SpectraBase Compound ID 5ZUUBFmkgnG
InChI InChI=1S/C25H34O4/c1-6-29-24(28)25(17-16-21(5)26,23(27)22-14-8-7-9-15-22)18-20(4)13-11-10-12-19(2)3/h7-9,12-15H,6,10-11,16-18H2,1-5H3/b20-13+
InChIKey OIABTAZFVYDSQX-DEDYPNTBSA-N
Mol Weight 398.5 g/mol
Molecular Formula C25H34O4
Exact Mass 398.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GFlI5O5aZ55
Name 4,8-DECADIENOIC ACID, 2-BENZOYL-5,9-DIMETHYL-2-(3-OXO-1-BUTYL)-, ETHY L ESTER, (E)-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C25H34O4
InChI InChI=1S/C25H34O4/c1-6-29-24(28)25(17-16-21(5)26,23(27)22-14-8-7-9-15-22)18-20(4)13-11-10-12-19(2)3/h7-9,12-15H,6,10-11,16-18H2,1-5H3/b20-13+
InChIKey OIABTAZFVYDSQX-DEDYPNTBSA-N
Instrument Name 311A
Molecular Weight 398.2448
SMILES CC(=CCC\C=C/(C)CC(CCC(C)=O)(C(c1ccccc1)=O)C(OCC)=O)C
SPLASH splash10-0a4i-4950000000-09ec9edd92b455a47804
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany