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(R)-N-(Trifluoromethylcarbonyl)-S-(p-tolyl)trifluoropyruvaldehyde
SpectraBase Compound ID JQRxqwKIuuT
InChI InChI=1S/C12H9F6NO2S/c1-7-2-4-8(5-3-7)22-10(6-20,12(16,17)18)19-9(21)11(13,14)15/h2-6H,1H3,(H,19,21)/t10-/m1/s1
InChIKey JFWHCDWOFXDHTN-SNVBAGLBSA-N
Mol Weight 345.26 g/mol
Molecular Formula C12H9F6NO2S
Exact Mass 345.025819 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3lfG5U2mXMJ
Name (R)-N-(Trifluoromethylcarbonyl)-S-(p-tolyl)trifluoropyruvaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9F6NO2S
InChI InChI=1S/C12H9F6NO2S/c1-7-2-4-8(5-3-7)22-10(6-20,12(16,17)18)19-9(21)11(13,14)15/h2-6H,1H3,(H,19,21)/t10-/m1/s1
InChIKey JFWHCDWOFXDHTN-SNVBAGLBSA-N
Molecular Weight 345.259 g/mol
SMILES N([C@@](C(F)(F)F)(Sc1ccc(cc1)C)C=O)C(C(F)(F)F)=O
SPLASH splash10-00di-3904000000-3d0a69415ac05d53158b
Source of Spectrum J-62-8039-2
Synonyms 2,2,2-Trifluoro-N-((R)-2,2,2-trifluoro-1-formyl-1-p-tolylsulfanyl-ethyl)-acetamide 2,2,2-trifluoro-N-{2,2,2-trifluoro-1-formyl-1-[(4-methylphenyl)sulfanyl]ethyl}acetamide
Wiley ID 1338462