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Glutaric acid, 1,1,1-trifluoroprop-2-yl undec-2-enyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 1,1,1-trifluoroprop-2-yl undec-2-enyl ester
SpectraBase Compound ID LV88lqr9Dmh
InChI InChI=1S/C19H31F3O4/c1-3-4-5-6-7-8-9-10-11-15-25-17(23)13-12-14-18(24)26-16(2)19(20,21)22/h10-11,16H,3-9,12-15H2,1-2H3/b11-10+
InChIKey KGIVMRHOPXJLCR-ZHACJKMWSA-N
Mol Weight 380.45 g/mol
Molecular Formula C19H31F3O4
Exact Mass 380.217444 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ANLTrIKTf33
Name Glutaric acid, 1,1,1-trifluoroprop-2-yl undec-2-enyl ester
Comments Computed using HOSE algorithm
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Exact Mass 380.217443963 u
Formula C19H31F3O4
InChI InChI=1S/C19H31F3O4/c1-3-4-5-6-7-8-9-10-11-15-25-17(23)13-12-14-18(24)26-16(2)19(20,21)22/h10-11,16H,3-9,12-15H2,1-2H3/b11-10+
InChIKey KGIVMRHOPXJLCR-ZHACJKMWSA-N
Molecular Weight 380.448 g/mol
SMILES C(CCC(OC(C)C(F)(F)F)=O)C(OC\C=C\CCCCCCCC)=O