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5-Methyl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)-2-pyrazolin-3-ol
SpectraBase Compound ID FwCHtcJUupR
InChI InChI=1S/C12H14F3N3OS/c1-7-6-11(19,12(13,14)15)18(17-7)10-16-8-4-2-3-5-9(8)20-10/h19H,2-6H2,1H3
InChIKey TYBVGCFLOCZWSR-UHFFFAOYSA-N
Mol Weight 305.32 g/mol
Molecular Formula C12H14F3N3OS
Exact Mass 305.080968 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7qtYBCw2X0R
Name 5-Methyl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)-2-pyrazolin-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14F3N3OS
InChI InChI=1S/C12H14F3N3OS/c1-7-6-11(19,12(13,14)15)18(17-7)10-16-8-4-2-3-5-9(8)20-10/h19H,2-6H2,1H3
InChIKey TYBVGCFLOCZWSR-UHFFFAOYSA-N
Molecular Weight 305.319 g/mol
SMILES OC1(N(c2nc3CCCCc3s2)N=C(C)C1)C(F)(F)F
SPLASH splash10-000f-0975000000-df2b28692f7a6e66ac8b
Source of Spectrum C5-2002-1081-3
Synonyms 5-Methyl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)-4H-pyrazol-3-ol
Wiley ID 1614722