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

*Links on SpectraBase are not permalinks.
ethyl 2-benzoyl-3-(cyclohexylmethyl)nonanoate
SpectraBase Compound ID DS68bJKOO8k
InChI InChI=1S/C25H38O3/c1-3-5-6-11-18-22(19-20-14-9-7-10-15-20)23(25(27)28-4-2)24(26)21-16-12-8-13-17-21/h8,12-13,16-17,20,22-23H,3-7,9-11,14-15,18-19H2,1-2H3
InChIKey QDFOOLVCRBPADV-UHFFFAOYSA-N
Mol Weight 386.6 g/mol
Molecular Formula C25H38O3
Exact Mass 386.282095 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 3kxz8WlKtM
Name ethyl 2-benzoyl-3-(cyclohexylmethyl)nonanoate
Appearance Pale yellow oily liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H38O3
InChI InChI=1S/C25H38O3/c1-3-5-6-11-18-22(19-20-14-9-7-10-15-20)23(25(27)28-4-2)24(26)21-16-12-8-13-17-21/h8,12-13,16-17,20,22-23H,3-7,9-11,14-15,18-19H2,1-2H3
InChIKey QDFOOLVCRBPADV-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 386.576 g/mol
Reported Formula C25H39O3
SMILES C(C(C(C(OCC)=O)C(=O)c1ccccc1)CC1CCCCC1)CCCCC
SPLASH splash10-0a4l-0900000000-62e0a79671bcfbcd88c7
Sample Comments dr = 1.1:1
Source of Spectrum CN108640839A
Wiley ID 1872451