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Cinnamic acid, 3-trifluoromethyl-, 2-ethylcyclohexyl ester

View entire compound with spectra: 1 NMR

Cinnamic acid, 3-trifluoromethyl-, 2-ethylcyclohexyl ester
SpectraBase Compound ID EeMbR95oxQj
InChI InChI=1S/C18H21F3O2/c1-2-14-7-3-4-9-16(14)23-17(22)11-10-13-6-5-8-15(12-13)18(19,20)21/h5-6,8,10-12,14,16H,2-4,7,9H2,1H3/b11-10+
InChIKey AIJFJLBGGBFPOA-ZHACJKMWSA-N
Mol Weight 326.36 g/mol
Molecular Formula C18H21F3O2
Exact Mass 326.149364 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4p2sFDKO7ov
Name Cinnamic acid, 3-trifluoromethyl-, 2-ethylcyclohexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 326.149364403 u
Formula C18H21F3O2
InChI InChI=1S/C18H21F3O2/c1-2-14-7-3-4-9-16(14)23-17(22)11-10-13-6-5-8-15(12-13)18(19,20)21/h5-6,8,10-12,14,16H,2-4,7,9H2,1H3/b11-10+
InChIKey AIJFJLBGGBFPOA-ZHACJKMWSA-N
Molecular Weight 326.359 g/mol
SMILES C1(OC(\C=C\C=2C=CC=C(C2)C(F)(F)F)=O)C(CC)CCCC1