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

*Links on SpectraBase are not permalinks.
Glutaric acid, hex-4-yn-3-yl isopropyl ester
SpectraBase Compound ID Kbj8Uus3Xkp
InChI InChI=1S/C14H22O4/c1-5-8-12(6-2)18-14(16)10-7-9-13(15)17-11(3)4/h11-12H,6-7,9-10H2,1-4H3
InChIKey IWSGVRJOUPVCJO-UHFFFAOYSA-N
Mol Weight 254.33 g/mol
Molecular Formula C14H22O4
Exact Mass 254.151809 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 HzpzCje4BNb
Name Glutaric acid, hex-4-yn-3-yl isopropyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 254.151809184 u
Formula C14H22O4
InChI InChI=1S/C14H22O4/c1-5-8-12(6-2)18-14(16)10-7-9-13(15)17-11(3)4/h11-12H,6-7,9-10H2,1-4H3
InChIKey IWSGVRJOUPVCJO-UHFFFAOYSA-N
Molecular Weight 254.326 g/mol
SMILES C(CCC(OC(CC)C#CC)=O)C(OC(C)C)=O