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

*Links on SpectraBase are not permalinks.

5-Methyl-4-pentyl-3-phenyl-2(5H)-furanone

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

5-Methyl-4-pentyl-3-phenyl-2(5H)-furanone
SpectraBase Compound ID 3vqgMjw0xdh
InChI InChI=1S/C16H20O2/c1-3-4-6-11-14-12(2)18-16(17)15(14)13-9-7-5-8-10-13/h5,7-10,12H,3-4,6,11H2,1-2H3
InChIKey IRABPIIYKQCCND-UHFFFAOYSA-N
Mol Weight 244.33 g/mol
Molecular Formula C16H20O2
Exact Mass 244.14633 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 E4fKLS6r4fx
Name 5-Methyl-4-pentyl-3-phenyl-2(5H)-furanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 244.146329882 u
Formula C16H20O2
InChI InChI=1S/C16H20O2/c1-3-4-6-11-14-12(2)18-16(17)15(14)13-9-7-5-8-10-13/h5,7-10,12H,3-4,6,11H2,1-2H3
InChIKey IRABPIIYKQCCND-UHFFFAOYSA-N
Molecular Weight 244.334 g/mol
SMILES C1(C(=C(CCCCC)C(O1)C)C=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.936207