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(2S)-2-(p-tolylsulfinylamino)-2-(trifluoromethyl)pent-4-enoic acid ethyl ester
SpectraBase Compound ID AhZQc4rulcy
InChI InChI=1S/C15H18F3NO3S/c1-4-10-14(15(16,17)18,13(20)22-5-2)19-23(21)12-8-6-11(3)7-9-12/h4,6-9,19H,1,5,10H2,2-3H3/t14-,23?/m0/s1
InChIKey VJKBZNSZAVBKDZ-JRQMZCAUSA-N
Mol Weight 349.37 g/mol
Molecular Formula C15H18F3NO3S
Exact Mass 349.095949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 46LrbZMz8Ww
Name (2S)-2-(p-tolylsulfinylamino)-2-(trifluoromethyl)pent-4-enoic acid ethyl ester
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Formula C15H18F3NO3S
InChI InChI=1S/C15H18F3NO3S/c1-4-10-14(15(16,17)18,13(20)22-5-2)19-23(21)12-8-6-11(3)7-9-12/h4,6-9,19H,1,5,10H2,2-3H3/t14-,23?/m0/s1
InChIKey VJKBZNSZAVBKDZ-JRQMZCAUSA-N
Molecular Weight 349.368 g/mol
SMILES N([C@](C(F)(F)F)(C(=O)OCC)CC=C)[S@](c1ccc(cc1)C)=O
SPLASH splash10-03di-0098000000-8e6ab2693980575cb4f7
Source of Spectrum K1-2001-1455-12
Synonyms (2S)-2-[(4-methylphenyl)sulfinylamino]-2-(trifluoromethyl)-4-pentenoic acid ethyl ester Ethyl (2S)-2-(p-tolylsulfinylamino)-2-(trifluoromethyl)pent-4-enoate Ethyl (2S)-2-[(4-methylphenyl)sulfinylamino]-2-(trifluoromethyl)pent-4-enoate
Wiley ID 814501