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

View entire compound with spectra: 1 NMR

Glutaric acid, dodec-2-en-1-yl 2-ethylhexyl ester
SpectraBase Compound ID 430B1MwHPHh
InChI InChI=1S/C25H46O4/c1-4-7-9-10-11-12-13-14-15-16-21-28-24(26)19-17-20-25(27)29-22-23(6-3)18-8-5-2/h15-16,23H,4-14,17-22H2,1-3H3/b16-15+
InChIKey RJGQLOZYOUVTIK-FOCLMDBBSA-N
Mol Weight 410.6 g/mol
Molecular Formula C25H46O4
Exact Mass 410.33961 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ltv9aOfaegl
Name Glutaric acid, dodec-2-en-1-yl 2-ethylhexyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 410.339609957 u
Formula C25H46O4
InChI InChI=1S/C25H46O4/c1-4-7-9-10-11-12-13-14-15-16-21-28-24(26)19-17-20-25(27)29-22-23(6-3)18-8-5-2/h15-16,23H,4-14,17-22H2,1-3H3/b16-15+
InChIKey RJGQLOZYOUVTIK-FOCLMDBBSA-N
Molecular Weight 410.639 g/mol
SMILES C(CCC(OC\C=C\CCCCCCCCC)=O)C(OCC(CC)CCCC)=O