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

*Links on SpectraBase are not permalinks.

Glutaric acid, hex-4-yn-3-yl 3-methylbut-3-en-1-yl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Glutaric acid, hex-4-yn-3-yl 3-methylbut-3-en-1-yl ester
SpectraBase Compound ID 98SrVTwV91J
InChI InChI=1S/C16H24O4/c1-5-8-14(6-2)20-16(18)10-7-9-15(17)19-12-11-13(3)4/h14H,3,6-7,9-12H2,1-2,4H3
InChIKey CTDNYVOARKYKJU-UHFFFAOYSA-N
Mol Weight 280.36 g/mol
Molecular Formula C16H24O4
Exact Mass 280.167459 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID AN4Cwr3sKFV
Name Glutaric acid, hex-4-yn-3-yl 3-methylbut-3-en-1-yl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 280.167459249 u
Formula C16H24O4
InChI InChI=1S/C16H24O4/c1-5-8-14(6-2)20-16(18)10-7-9-15(17)19-12-11-13(3)4/h14H,3,6-7,9-12H2,1-2,4H3
InChIKey CTDNYVOARKYKJU-UHFFFAOYSA-N
SMILES C(CCC(OC(CC)C#CC)=O)C(OCCC(C)=C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.952651