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(1R,6R)-6-[3-(perfluorophenyl)prop-2-yl]-3-methyl-cyclohex-2-en-1-carboxylic acid methyl ester
SpectraBase Compound ID KXkq3XRFnGg
InChI InChI=1S/C18H19F5O2/c1-8-4-5-10(11(6-8)18(24)25-3)9(2)7-12-13(19)15(21)17(23)16(22)14(12)20/h6,9-11H,4-5,7H2,1-3H3/t9?,10-,11+/m1/s1
InChIKey SPQKYPWANQFIAB-ZOCYIJKUSA-N
Mol Weight 362.34 g/mol
Molecular Formula C18H19F5O2
Exact Mass 362.130521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 334C5nl1jEU
Name (1R,6R)-6-[3-(perfluorophenyl)prop-2-yl]-3-methyl-cyclohex-2-en-1-carboxylic acid methyl ester
Alternate Name(s) Methyl 6-[3-(perfluorophenyl)prop-2-yl]-3-methyl-cyclohex-2-en-1-carboxylate isomer (1R,6R)-3-Methyl-6-(1-methyl-2-pentafluorophenyl-ethyl)-cyclohex-2-enecarboxylic acid methyl ester Methyl (1R,6R)-3-methyl-6-[(1R)-1-methyl-2-(2,3,4,5,6-pentafluorophenyl)ethyl]-2-cyclohexene-1-carboxylate Methyl 6-[3-(perfluorophenyl)prop-2-yl]-3-methyl-cyclohex-2-en-1-carboxylate
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Formula C18H19F5O2
InChI InChI=1S/C18H19F5O2/c1-8-4-5-10(11(6-8)18(24)25-3)9(2)7-12-13(19)15(21)17(23)16(22)14(12)20/h6,9-11H,4-5,7H2,1-3H3/t9?,10-,11+/m1/s1
InChIKey SPQKYPWANQFIAB-ZOCYIJKUSA-N
Molecular Weight 362.340 g/mol
SMILES c1(c(c(F)c(c(c1F)F)F)F)CC([C@@]1([C@](C=C(CC1)C)(C(=O)OC)[H])[H])C
SPLASH splash10-003u-9200000000-105bb3def600f0a230ae
Source of Spectrum F-54-13861-14
Wiley ID 809535