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

*Links on SpectraBase are not permalinks.

Succinic acid, pentyl trans-4-tert-butylcyclohexyl ester

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

Succinic acid, pentyl trans-4-tert-butylcyclohexyl ester
SpectraBase Compound ID Jrzha0M7MNZ
InChI InChI=1S/C19H34O4/c1-5-6-7-14-22-17(20)12-13-18(21)23-16-10-8-15(9-11-16)19(2,3)4/h15-16H,5-14H2,1-4H3
InChIKey FCGUKBOARUEVQB-UHFFFAOYSA-N
Mol Weight 326.5 g/mol
Molecular Formula C19H34O4
Exact Mass 326.24571 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 K35kiPPP8TK
Name Succinic acid, pentyl trans-4-tert-butylcyclohexyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 326.245709571 u
Formula C19H34O4
InChI InChI=1S/C19H34O4/c1-5-6-7-14-22-17(20)12-13-18(21)23-16-10-8-15(9-11-16)19(2,3)4/h15-16H,5-14H2,1-4H3
InChIKey FCGUKBOARUEVQB-UHFFFAOYSA-N
Molecular Weight 326.477 g/mol
SMILES C(CC(OC1CCC(C(C)(C)C)CC1)=O)C(OCCCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.957115