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Glutaric acid, di(undec-2-enyl) ester

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

Glutaric acid, di(undec-2-enyl) ester
SpectraBase Compound ID J9xAdagOtsQ
InChI InChI=1S/C27H48O4/c1-3-5-7-9-11-13-15-17-19-24-30-26(28)22-21-23-27(29)31-25-20-18-16-14-12-10-8-6-4-2/h17-20H,3-16,21-25H2,1-2H3/b19-17+,20-18+
InChIKey JRXDRUBEBHAQBE-XPWSMXQVSA-N
Mol Weight 436.7 g/mol
Molecular Formula C27H48O4
Exact Mass 436.35526 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID K5asmiBSR4l
Name Glutaric acid, di(undec-2-enyl) ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 436.355260022 u
Formula C27H48O4
InChI InChI=1S/C27H48O4/c1-3-5-7-9-11-13-15-17-19-24-30-26(28)22-21-23-27(29)31-25-20-18-16-14-12-10-8-6-4-2/h17-20H,3-16,21-25H2,1-2H3/b19-17+,20-18+
InChIKey JRXDRUBEBHAQBE-XPWSMXQVSA-N
Molecular Weight 436.677 g/mol
SMILES C(CCC(OC\C=C\CCCCCCCC)=O)C(OC\C=C\CCCCCCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.954068