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Glutaric acid, dodec-2-en-1-yl 2,4-dimethylpent-3-yl ester

View entire compound with spectra: 1 NMR

Glutaric acid, dodec-2-en-1-yl 2,4-dimethylpent-3-yl ester
SpectraBase Compound ID GY6JvSYEEkS
InChI InChI=1S/C24H44O4/c1-6-7-8-9-10-11-12-13-14-15-19-27-22(25)17-16-18-23(26)28-24(20(2)3)21(4)5/h14-15,20-21,24H,6-13,16-19H2,1-5H3/b15-14+
InChIKey GUXICJNWURNNJS-CCEZHUSRSA-N
Mol Weight 396.6 g/mol
Molecular Formula C24H44O4
Exact Mass 396.32396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ISfFGYVgph0
Name Glutaric acid, dodec-2-en-1-yl 2,4-dimethylpent-3-yl ester
Comments Computed using HOSE algorithm
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Exact Mass 396.323959893 u
Formula C24H44O4
InChI InChI=1S/C24H44O4/c1-6-7-8-9-10-11-12-13-14-15-19-27-22(25)17-16-18-23(26)28-24(20(2)3)21(4)5/h14-15,20-21,24H,6-13,16-19H2,1-5H3/b15-14+
InChIKey GUXICJNWURNNJS-CCEZHUSRSA-N
Molecular Weight 396.612 g/mol
SMILES C(CCC(OC\C=C\CCCCCCCCC)=O)C(OC(C(C)C)C(C)C)=O