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trans 2-(2-(3,5-bis(trifluoromethyl)phenyl)cyclopropyl)-2,4-dimethylpentan-3-one
SpectraBase Compound ID AiUjB65f2Xq
InChI InChI=1S/C18H20F6O/c1-9(2)15(25)16(3,4)14-8-13(14)10-5-11(17(19,20)21)7-12(6-10)18(22,23)24/h5-7,9,13-14H,8H2,1-4H3/t13-,14+/m0/s1
InChIKey SXSUARBDGOOLMR-UONOGXRCSA-N
Mol Weight 366.35 g/mol
Molecular Formula C18H20F6O
Exact Mass 366.141834 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Ppex7lRs2a
Name trans 2-(2-(3,5-bis(trifluoromethyl)phenyl)cyclopropyl)-2,4-dimethylpentan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20F6O
InChI InChI=1S/C18H20F6O/c1-9(2)15(25)16(3,4)14-8-13(14)10-5-11(17(19,20)21)7-12(6-10)18(22,23)24/h5-7,9,13-14H,8H2,1-4H3/t13-,14+/m0/s1
InChIKey SXSUARBDGOOLMR-UONOGXRCSA-N
Literature Reference DOI 10.1002/ajoc.201700541
Molecular Weight 366.347 g/mol
SMILES C(C(=O)C(C)(C)[C@]1([C@@](C1)(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)[H])[H])(C)C
SPLASH splash10-00di-9031000000-01b115fb5ca31a5fc9bc
Source of Spectrum AJO-6-SM8-3w
Synonyms 2-((1R,2R)-2-(3,5-bis(trifluoromethyl)phenyl)cyclopropyl)-2,4-dimethylpentan-3-one
Wiley ID 1813062