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Succinic acid, hex-4-yn-3-yl tetradec-3-en-1-yl ester

View entire compound with spectra: 1 NMR

Succinic acid, hex-4-yn-3-yl tetradec-3-en-1-yl ester
SpectraBase Compound ID 2KNbQ4Q5h6e
InChI InChI=1S/C24H40O4/c1-4-7-8-9-10-11-12-13-14-15-16-17-21-27-23(25)19-20-24(26)28-22(6-3)18-5-2/h15-16,22H,4,6-14,17,19-21H2,1-3H3/b16-15+
InChIKey VNXQGQBEMCSBIK-FOCLMDBBSA-N
Mol Weight 392.6 g/mol
Molecular Formula C24H40O4
Exact Mass 392.29266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4mVSJBjM3b1
Name Succinic acid, hex-4-yn-3-yl tetradec-3-en-1-yl ester
Comments Computed using HOSE algorithm
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Exact Mass 392.292659764 u
Formula C24H40O4
InChI InChI=1S/C24H40O4/c1-4-7-8-9-10-11-12-13-14-15-16-17-21-27-23(25)19-20-24(26)28-22(6-3)18-5-2/h15-16,22H,4,6-14,17,19-21H2,1-3H3/b16-15+
InChIKey VNXQGQBEMCSBIK-FOCLMDBBSA-N
Molecular Weight 392.580 g/mol
SMILES C(CC(OC(CC)C#CC)=O)C(OCC\C=C\CCCCCCCCCC)=O