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Glutaric acid, decyl 4-(trifluoromethyl)benzyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, decyl 4-(trifluoromethyl)benzyl ester
SpectraBase Compound ID 83gTFhh4XCt
InChI InChI=1S/C23H33F3O4/c1-2-3-4-5-6-7-8-9-17-29-21(27)11-10-12-22(28)30-18-19-13-15-20(16-14-19)23(24,25)26/h13-16H,2-12,17-18H2,1H3
InChIKey PXAWAMVOMWYIFP-UHFFFAOYSA-N
Mol Weight 430.5 g/mol
Molecular Formula C23H33F3O4
Exact Mass 430.233094 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 24I2szR6QVS
Name Glutaric acid, decyl 4-(trifluoromethyl)benzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 430.233094028 u
Formula C23H33F3O4
InChI InChI=1S/C23H33F3O4/c1-2-3-4-5-6-7-8-9-17-29-21(27)11-10-12-22(28)30-18-19-13-15-20(16-14-19)23(24,25)26/h13-16H,2-12,17-18H2,1H3
InChIKey PXAWAMVOMWYIFP-UHFFFAOYSA-N
Molecular Weight 430.508 g/mol
SMILES C(OCC1=CC=C(C=C1)C(F)(F)F)(=O)CCCC(OCCCCCCCCCC)=O