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

*Links on SpectraBase are not permalinks.

Cyclononadecanone, 3,5,18-trimethyl-

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

Cyclononadecanone, 3,5,18-trimethyl-
SpectraBase Compound ID KnIOHBiRGU8
InChI InChI=1S/C22H42O/c1-19-14-12-10-8-6-4-5-7-9-11-13-15-20(2)17-22(23)18-21(3)16-19/h19-21H,4-18H2,1-3H3
InChIKey MEPYGJWDYAJRKY-UHFFFAOYSA-N
Mol Weight 322.6 g/mol
Molecular Formula C22H42O
Exact Mass 322.323566 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

Subscribe to view the full spectrum.

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

SpectraBase Spectrum ID 2QDh07gEFGr
Name Cyclononadecanone, 3,5,18-trimethyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 322.323565971 u
Formula C22H42O
InChI InChI=1S/C22H42O/c1-19-14-12-10-8-6-4-5-7-9-11-13-15-20(2)17-22(23)18-21(3)16-19/h19-21H,4-18H2,1-3H3
InChIKey MEPYGJWDYAJRKY-UHFFFAOYSA-N
Molecular Weight 322.577 g/mol
SMILES C1(=O)CC(CC(C)CCCCCCCCCCCCC(C1)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.898222