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(3S,4S)-3-(4-chlorophenyl)-3-ethyl-4-phenyl-4-(trifluoromethyl)oxetan-2-one
SpectraBase Compound ID BhUr93o5TXA
InChI InChI=1S/C18H14ClF3O2/c1-2-16(12-8-10-14(19)11-9-12)15(23)24-17(16,18(20,21)22)13-6-4-3-5-7-13/h3-11H,2H2,1H3/t16-,17+/m1/s1
InChIKey IWVMSWDSAJISAY-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 7dFgFFjsb3S
Name (3S,4S)-3-(4-chlorophenyl)-3-ethyl-4-phenyl-4-(trifluoromethyl)oxetan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14ClF3O2
InChI InChI=1S/C18H14ClF3O2/c1-2-16(12-8-10-14(19)11-9-12)15(23)24-17(16,18(20,21)22)13-6-4-3-5-7-13/h3-11H,2H2,1H3/t16-,17+/m1/s1
InChIKey IWVMSWDSAJISAY-SJORKVTESA-N
Literature Reference DOI 10.1021/ol901290z
Molecular Weight 354.756 g/mol
SMILES [C@]1([C@](c2ccc(cc2)Cl)(C(O1)=O)CC)(c1ccccc1)C(F)(F)F
SPLASH splash10-001i-0900000000-457f34dd3faca5c044b0
Source of Spectrum A1-11-4029/SMS8-3d
Wiley ID 1757081