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Succinic acid, cyclohexylmethyl 2-decyl ester

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

Succinic acid, cyclohexylmethyl 2-decyl ester
SpectraBase Compound ID EGiCUbalupz
InChI InChI=1S/C21H38O4/c1-3-4-5-6-7-9-12-18(2)25-21(23)16-15-20(22)24-17-19-13-10-8-11-14-19/h18-19H,3-17H2,1-2H3
InChIKey KWXGRCXXBPEPRK-UHFFFAOYSA-N
Mol Weight 354.5 g/mol
Molecular Formula C21H38O4
Exact Mass 354.27701 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ev3fjR6oJhO
Name Succinic acid, cyclohexylmethyl 2-decyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 354.277009700 u
Formula C21H38O4
InChI InChI=1S/C21H38O4/c1-3-4-5-6-7-9-12-18(2)25-21(23)16-15-20(22)24-17-19-13-10-8-11-14-19/h18-19H,3-17H2,1-2H3
InChIKey KWXGRCXXBPEPRK-UHFFFAOYSA-N
Molecular Weight 354.531 g/mol
SMILES C(CC(OCC1CCCCC1)=O)C(OC(CCCCCCCC)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.949104