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1,5-Pentanediol, o,o'-di(3-cyclopentylpropionyl)-

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

1,5-Pentanediol, o,o'-di(3-cyclopentylpropionyl)-
SpectraBase Compound ID 306FbChQkXn
InChI InChI=1S/C21H36O4/c22-20(14-12-18-8-2-3-9-18)24-16-6-1-7-17-25-21(23)15-13-19-10-4-5-11-19/h18-19H,1-17H2
InChIKey CYADWHYLQLNPOM-UHFFFAOYSA-N
Mol Weight 352.5 g/mol
Molecular Formula C21H36O4
Exact Mass 352.26136 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HCN420bFmRB
Name 1,5-Pentanediol, o,o'-di(3-cyclopentylpropionyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 352.261359635 u
Formula C21H36O4
InChI InChI=1S/C21H36O4/c22-20(14-12-18-8-2-3-9-18)24-16-6-1-7-17-25-21(23)15-13-19-10-4-5-11-19/h18-19H,1-17H2
InChIKey CYADWHYLQLNPOM-UHFFFAOYSA-N
Molecular Weight 352.515 g/mol
SMILES C(CCC1CCCC1)(OCCCCCOC(CCC1CCCC1)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.973878