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(3S,4S)-4-(4-chlorophenyl)-3-methyl-3-p-tolyl-4-(trifluoromethyl)oxetan-2-one
SpectraBase Compound ID 9xhwyGPRaa5
InChI InChI=1S/C18H14ClF3O2/c1-11-3-5-12(6-4-11)16(2)15(23)24-17(16,18(20,21)22)13-7-9-14(19)10-8-13/h3-10H,1-2H3/t16-,17+/m1/s1
InChIKey AREJCOZMDYZCGT-SJORKVTESA-N
Mol Weight 354.76 g/mol
Molecular Formula C18H14ClF3O2
Exact Mass 354.063442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 77zBur7rpsY
Name (3S,4S)-4-(4-chlorophenyl)-3-methyl-3-p-tolyl-4-(trifluoromethyl)oxetan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14ClF3O2
InChI InChI=1S/C18H14ClF3O2/c1-11-3-5-12(6-4-11)16(2)15(23)24-17(16,18(20,21)22)13-7-9-14(19)10-8-13/h3-10H,1-2H3/t16-,17+/m1/s1
InChIKey AREJCOZMDYZCGT-SJORKVTESA-N
Literature Reference DOI 10.1021/ol901290z
Molecular Weight 354.756 g/mol
SMILES [C@]1(c2ccc(cc2)Cl)(C(F)(F)F)[C@@](C(O1)=O)(c1ccc(cc1)C)C
SPLASH splash10-0002-0900000000-bc82d94d0523f9ab532a
Source of Spectrum A1-11-4029/SMS14-3l
Synonyms (3S,4S)-4-(4-chlorophenyl)-3-methyl-3-(p-tolyl)-4-(trifluoromethyl)oxetan-2-one (3S,4S)-4-(4-chlorophenyl)-3-methyl-3-(4-methylphenyl)-4-(trifluoromethyl)-2-oxetanone (3S,4S)-4-(4-chlorophenyl)-3-methyl-3-(4-methylphenyl)-4-(trifluoromethyl)oxetan-2-one
Wiley ID 1757088