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5-HYDROXY-3-(S,S-DIMETHYLSULFOXIMIDO)-5-TRIFLUOROMETHYL)-4,5-DIHYDRO-1H-1-(PARA-TOSYLPYRAZOLE)
SpectraBase Compound ID 60QFeSDU7uh
InChI InChI=1S/C13H16F3N3O4S2/c1-9-4-6-10(7-5-9)25(22,23)19-12(20,13(14,15)16)8-11(17-19)18-24(2,3)21/h4-7,20H,8H2,1-3H3
InChIKey GDNSCLHMIPGVDA-UHFFFAOYSA-N
Mol Weight 399.4 g/mol
Molecular Formula C13H16F3N3O4S2
Exact Mass 399.053433 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6jRgpdR4Jsj
Name 5-Hydroxy-3-(S,S-dimethylsulfoximido)-5-(trifluoromethyl)-4,5-dihydro-1H-1-(tosylpyrazole)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16F3N3O4S2
InChI InChI=1S/C13H16F3N3O4S2/c1-9-4-6-10(7-5-9)25(22,23)19-12(20,13(14,15)16)8-11(17-19)18-24(2,3)21/h4-7,20H,8H2,1-3H3
InChIKey GDNSCLHMIPGVDA-UHFFFAOYSA-N
Molecular Weight 399.403 g/mol
SMILES OC1(N(S(c2ccc(C)cc2)(=O)=O)N=C(N=S(=O)(C)C)C1)C(F)(F)F
SPLASH splash10-0ufr-9820000000-53dd5f5b66406a3531d7
Source of Spectrum D9-20-1375-4c
Wiley ID 1695448