For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzenebutanoic acid, 4-pentyl-.beta.-(4-propylphenyl)-, ethyl ester
SpectraBase Compound ID Jo8VmSUyJOL
InChI InChI=1S/C26H36O2/c1-4-7-8-10-22-11-13-23(14-12-22)19-25(20-26(27)28-6-3)24-17-15-21(9-5-2)16-18-24/h11-18,25H,4-10,19-20H2,1-3H3
InChIKey ODRKXILXTDIQIU-UHFFFAOYSA-N
Mol Weight 380.6 g/mol
Molecular Formula C26H36O2
Exact Mass 380.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4thikaw7rDZ
Name Benzenebutanoic acid, 4-pentyl-.beta.-(4-propylphenyl)-, ethyl ester
Alternate Name(s) Ethyl 4-(4-pentylphenyl)-3-(4-propylphenyl)butanoate Ethyl 4-(4-pentylphenyl)-3-(4-propylphenyl)butyrate
CAS Registry Number 83787-93-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H36O2
InChI InChI=1S/C26H36O2/c1-4-7-8-10-22-11-13-23(14-12-22)19-25(20-26(27)28-6-3)24-17-15-21(9-5-2)16-18-24/h11-18,25H,4-10,19-20H2,1-3H3
InChIKey ODRKXILXTDIQIU-UHFFFAOYSA-N
Molecular Weight 380.572 g/mol
SMILES C(CC(=O)OCC)(c1ccc(cc1)CCC)Cc1ccc(cc1)CCCCC
SPLASH splash10-014i-0960000000-f7cd5bd10a459856c805
Source of Spectrum H-65-1329-0
Wiley ID 1359991