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(E)-3-cyclohexylallyl 2,3,6-trifluorobenzoate
SpectraBase Compound ID 3RvPPyql7Lo
InChI InChI=1S/C16H17F3O2/c17-12-8-9-13(18)15(19)14(12)16(20)21-10-4-7-11-5-2-1-3-6-11/h4,7-9,11H,1-3,5-6,10H2/b7-4+
InChIKey BAPKNIFDHXGSKS-QPJJXVBHSA-N
Mol Weight 298.31 g/mol
Molecular Formula C16H17F3O2
Exact Mass 298.118064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3KmBUKWxNZW
Name (E)-3-cyclohexylallyl 2,3,6-trifluorobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17F3O2
InChI InChI=1S/C16H17F3O2/c17-12-8-9-13(18)15(19)14(12)16(20)21-10-4-7-11-5-2-1-3-6-11/h4,7-9,11H,1-3,5-6,10H2/b7-4+
InChIKey BAPKNIFDHXGSKS-QPJJXVBHSA-N
Literature Reference DOI 10.1002/adsc.201400624
Molecular Weight 298.305 g/mol
SMILES C(c1c(c(ccc1F)F)F)(=O)OC\C=C\C1CCCCC1
SPLASH splash10-0a59-8900000000-173c6d612f90d011ffb0
Source of Spectrum ASC-356-3302/SM12-1r
Wiley ID 1769748