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Pentanoic acid, 4-[[4-hydroxy-3-(1-oxopentyl)phenyl]methyl]phenyl ester
SpectraBase Compound ID DA1Zq4xhaBN
InChI InChI=1S/C23H28O4/c1-3-5-7-21(24)20-16-18(11-14-22(20)25)15-17-9-12-19(13-10-17)27-23(26)8-6-4-2/h9-14,16,25H,3-8,15H2,1-2H3
InChIKey OGMUHXYVTCHBQO-UHFFFAOYSA-N
Mol Weight 368.47 g/mol
Molecular Formula C23H28O4
Exact Mass 368.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3LYzi0qnoOC
Name Pentanoic acid, 4-[[4-hydroxy-3-(1-oxopentyl)phenyl]methyl]phenyl ester
CAS Registry Number 55724-87-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H28O4
InChI InChI=1S/C23H28O4/c1-3-5-7-21(24)20-16-18(11-14-22(20)25)15-17-9-12-19(13-10-17)27-23(26)8-6-4-2/h9-14,16,25H,3-8,15H2,1-2H3
InChIKey OGMUHXYVTCHBQO-UHFFFAOYSA-N
Molecular Weight 368.473 g/mol
SMILES Oc1ccc(cc1C(CCCC)=O)Cc1ccc(cc1)OC(CCCC)=O
SPLASH splash10-056r-2790000000-3a41be6661819dac0ae1
Source of Spectrum SD-1981-0-0
Synonyms 4-(4-Hydroxy-3-pentanoylbenzyl)phenyl pentanoate Pentanoic acid [4-[[4-hydroxy-3-(1-oxopentyl)phenyl]methyl]phenyl] ester [4-[(4-hydroxy-3-pentanoylphenyl)methyl]phenyl] pentanoate [4-[(4-hydroxy-3-pentanoyl-phenyl)methyl]phenyl] pentanoate [4-[(4-oxidanyl-3-pentanoyl-phenyl)methyl]phenyl] pentanoate
Wiley ID 1353284