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

*Links on SpectraBase are not permalinks.
Pimelic acid, 4-methylcyclohexyl nonyl ester isomer 1
SpectraBase Compound ID Ke7NgDWlxvh
InChI InChI=1S/C23H42O4/c1-3-4-5-6-7-8-12-19-26-22(24)13-10-9-11-14-23(25)27-21-17-15-20(2)16-18-21/h20-21H,3-19H2,1-2H3
InChIKey MZQXXNSMGNWZPB-UHFFFAOYSA-N
Mol Weight 382.6 g/mol
Molecular Formula C23H42O4
Exact Mass 382.30831 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 B7U9LMzclUu
Name Pimelic acid, 4-methylcyclohexyl nonyl ester isomer 1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H42O4
InChI InChI=1S/C23H42O4/c1-3-4-5-6-7-8-12-19-26-22(24)13-10-9-11-14-23(25)27-21-17-15-20(2)16-18-21/h20-21H,3-19H2,1-2H3
InChIKey MZQXXNSMGNWZPB-UHFFFAOYSA-N
Molecular Weight 382.585 g/mol
SMILES C(CCCCCC(OC1CCC(CC1)C)=O)(OCCCCCCCCC)=O
SPLASH splash10-0006-9710000000-0dcd01e6104a8bc7347a
Source of Spectrum TIPS-2022-509-0
Wiley ID 1822026