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

*Links on SpectraBase are not permalinks.

Glutaric acid, hexadecyl non-5-yn-3-yl ester

View entire compound with spectra: 1 NMR

Glutaric acid, hexadecyl non-5-yn-3-yl ester
SpectraBase Compound ID Kr25pofqEMB
InChI InChI=1S/C30H54O4/c1-4-7-9-11-12-13-14-15-16-17-18-19-20-22-27-33-29(31)25-23-26-30(32)34-28(6-3)24-21-10-8-5-2/h28H,4-9,11-20,22-27H2,1-3H3
InChIKey KSNHDEYPHDZEPD-UHFFFAOYSA-N
Mol Weight 478.8 g/mol
Molecular Formula C30H54O4
Exact Mass 478.40221 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 9DO1LQ4hNh7
Name Glutaric acid, hexadecyl non-5-yn-3-yl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 478.402210215 u
Formula C30H54O4
InChI InChI=1S/C30H54O4/c1-4-7-9-11-12-13-14-15-16-17-18-19-20-22-27-33-29(31)25-23-26-30(32)34-28(6-3)24-21-10-8-5-2/h28H,4-9,11-20,22-27H2,1-3H3
InChIKey KSNHDEYPHDZEPD-UHFFFAOYSA-N
Molecular Weight 478.758 g/mol
SMILES C(C#CCC(OC(CCCC(OCCCCCCCCCCCCCCCC)=O)=O)CC)CC