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

*Links on SpectraBase are not permalinks.
Pimelic acid, 3-methylbut-2-yl dodecyl ester
SpectraBase Compound ID 8m9W1mKJKq6
InChI InChI=1S/C24H46O4/c1-5-6-7-8-9-10-11-12-13-17-20-27-23(25)18-15-14-16-19-24(26)28-22(4)21(2)3/h21-22H,5-20H2,1-4H3
InChIKey XVKCAQAJMQTLRD-UHFFFAOYSA-N
Mol Weight 398.6 g/mol
Molecular Formula C24H46O4
Exact Mass 398.33961 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 9AbJwqOYjGR
Name Pimelic acid, 3-methylbut-2-yl dodecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H46O4
InChI InChI=1S/C24H46O4/c1-5-6-7-8-9-10-11-12-13-17-20-27-23(25)18-15-14-16-19-24(26)28-22(4)21(2)3/h21-22H,5-20H2,1-4H3
InChIKey XVKCAQAJMQTLRD-UHFFFAOYSA-N
Molecular Weight 398.628 g/mol
SMILES C(CCCCCC(OC(C(C)C)C)=O)(OCCCCCCCCCCCC)=O
SPLASH splash10-0006-7900000000-2995ce8a5e978b4727f9
Source of Spectrum TIPS-2022-1007-0
Wiley ID 1822524