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Glutaric acid, dodec-2-en-1-yl dec-9-enyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, dodec-2-en-1-yl dec-9-enyl ester
SpectraBase Compound ID 63Ak6Wqb4ji
InChI InChI=1S/C27H48O4/c1-3-5-7-9-11-13-14-16-18-20-25-31-27(29)23-21-22-26(28)30-24-19-17-15-12-10-8-6-4-2/h4,18,20H,2-3,5-17,19,21-25H2,1H3/b20-18+
InChIKey PEJKDMVELCPAAE-CZIZESTLSA-N
Mol Weight 436.7 g/mol
Molecular Formula C27H48O4
Exact Mass 436.35526 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1BXbwS9eWc4
Name Glutaric acid, dodec-2-en-1-yl dec-9-enyl ester
Comments Computed using HOSE algorithm
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Exact Mass 436.355260022 u
Formula C27H48O4
InChI InChI=1S/C27H48O4/c1-3-5-7-9-11-13-14-16-18-20-25-31-27(29)23-21-22-26(28)30-24-19-17-15-12-10-8-6-4-2/h4,18,20H,2-3,5-17,19,21-25H2,1H3/b20-18+
InChIKey PEJKDMVELCPAAE-CZIZESTLSA-N
Molecular Weight 436.677 g/mol
SMILES C(CCC(OC\C=C\CCCCCCCCC)=O)C(OCCCCCCCCC=C)=O