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3-Cyano-2-hexyl-cis-2-decenoic acid, methyl ester
SpectraBase Compound ID 6dNKjAvCu0r
InChI InChI=1S/C18H31NO2/c1-4-6-8-10-11-13-16(15-19)17(18(20)21-3)14-12-9-7-5-2/h4-14H2,1-3H3/b17-16+
InChIKey DWZQCYWZTMQCCW-WUKNDPDISA-N
Mol Weight 293.45 g/mol
Molecular Formula C18H31NO2
Exact Mass 293.235479 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 38CdgxIfRDR
Name 3-Cyano-2-hexyl-cis-2-decenoic acid, methyl ester
Comments HEN-C661
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Formula C18H31NO2
InChI InChI=1S/C18H31NO2/c1-4-6-8-10-11-13-16(15-19)17(18(20)21-3)14-12-9-7-5-2/h4-14H2,1-3H3/b17-16+
InChIKey DWZQCYWZTMQCCW-WUKNDPDISA-N
Instrument Name Varian CFT-20
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3