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

*Links on SpectraBase are not permalinks.

Oxacyclotetradecane-2,9-dione, 12-hydroxy-

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

Oxacyclotetradecane-2,9-dione, 12-hydroxy-
SpectraBase Compound ID 2uxNOhWLDlQ
InChI InChI=1S/C13H22O4/c14-11-5-3-1-2-4-6-13(16)17-10-9-12(15)8-7-11/h12,15H,1-10H2
InChIKey YEMDEDIUCXYXJI-UHFFFAOYSA-N
Mol Weight 242.31 g/mol
Molecular Formula C13H22O4
Exact Mass 242.151809 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 2UKhV34vAYZ
Name Oxacyclotetradecane-2,9-dione, 12-hydroxy-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 242.151809184 u
Formula C13H22O4
InChI InChI=1S/C13H22O4/c14-11-5-3-1-2-4-6-13(16)17-10-9-12(15)8-7-11/h12,15H,1-10H2
InChIKey YEMDEDIUCXYXJI-UHFFFAOYSA-N
Molecular Weight 242.315 g/mol
SMILES C1(OCCC(CCC(CCCCCC1)=O)O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.981751