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(1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl-4,4,4-trifluoro-2-hydroxy-2-methylbutanoate
SpectraBase Compound ID DX3Mha5ARii
InChI InChI=1S/C15H25F3O3/c1-9(2)11-6-5-10(3)7-12(11)21-13(19)14(4,20)8-15(16,17)18/h9-12,20H,5-8H2,1-4H3/t10-,11+,12-,14?/m1/s1
InChIKey ASMQDCQEONZILX-JIROBOQZSA-N
Mol Weight 310.36 g/mol
Molecular Formula C15H25F3O3
Exact Mass 310.175579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2lXN7Byx0j3
Name (1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexyl-4,4,4-trifluoro-2-hydroxy-2-methylbutanoate
Alternate Name(s) (1R,2S,5R)-2-isopropyl-5-methylcyclohexyl 4,4,4-trifluoro-2-hydroxy-2-methylbutanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H25F3O3
InChI InChI=1S/C15H25F3O3/c1-9(2)11-6-5-10(3)7-12(11)21-13(19)14(4,20)8-15(16,17)18/h9-12,20H,5-8H2,1-4H3/t10-,11+,12-,14?/m1/s1
InChIKey ASMQDCQEONZILX-JIROBOQZSA-N
Molecular Weight 310.357 g/mol
SMILES OC(CC(F)(F)F)(C(O[C@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H])=O)C
SPLASH splash10-001r-9400000000-31d36f2748cdad6c52bc
Source of Spectrum KC-61-10211-36
Wiley ID 1630982