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Glutaric acid, dodec-2-en-1-yl but-2-en-1-yl ester

View entire compound with spectra: 1 NMR

Glutaric acid, dodec-2-en-1-yl but-2-en-1-yl ester
SpectraBase Compound ID LJc25rMzuAq
InChI InChI=1S/C21H36O4/c1-3-5-7-8-9-10-11-12-13-14-19-25-21(23)17-15-16-20(22)24-18-6-4-2/h4,6,13-14H,3,5,7-12,15-19H2,1-2H3/b6-4+,14-13+
InChIKey CBXUGECHQZAIHE-IWXPDAORSA-N
Mol Weight 352.5 g/mol
Molecular Formula C21H36O4
Exact Mass 352.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8JAHRc475gz
Name Glutaric acid, dodec-2-en-1-yl but-2-en-1-yl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 352.261359635 u
Formula C21H36O4
InChI InChI=1S/C21H36O4/c1-3-5-7-8-9-10-11-12-13-14-19-25-21(23)17-15-16-20(22)24-18-6-4-2/h4,6,13-14H,3,5,7-12,15-19H2,1-2H3/b6-4+,14-13+
InChIKey CBXUGECHQZAIHE-IWXPDAORSA-N
Molecular Weight 352.515 g/mol
SMILES C(CCC(OC\C=C\CCCCCCCCC)=O)C(OC\C=C\C)=O