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1(3H)-Isobenzofuranone, 3-[5-hydroxy-3-(trifluoromethyl)-1H-pyrazol-4-yl]-
SpectraBase Compound ID Fer24QTL34L
InChI InChI=1S/C12H7F3N2O3/c13-12(14,15)9-7(10(18)17-16-9)8-5-3-1-2-4-6(5)11(19)20-8/h1-4,8H,(H2,16,17,18)
InChIKey DZAPOCCVABQFFF-UHFFFAOYSA-N
Mol Weight 284.19 g/mol
Molecular Formula C12H7F3N2O3
Exact Mass 284.040877 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7cZes0bktwz
Name 1(3H)-Isobenzofuranone, 3-[5-hydroxy-3-(trifluoromethyl)-1H-pyrazol-4-yl]-
Alternate Name(s) 4-(3-oxo-1H-2-benzofuran-1-yl)-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one 4-(3-oxo-1H-isobenzofuran-1-yl)-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one 4-(3-oxidanylidene-1H-2-benzofuran-1-yl)-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H7F3N2O3
InChI InChI=1S/C12H7F3N2O3/c13-12(14,15)9-7(10(18)17-16-9)8-5-3-1-2-4-6(5)11(19)20-8/h1-4,8H,(H2,16,17,18)
InChIKey DZAPOCCVABQFFF-UHFFFAOYSA-N
Molecular Weight 284.194 g/mol
SMILES [nH]1nc(c(c1O)C1OC(=O)c2ccccc12)C(F)(F)F
SPLASH splash10-002r-7960000000-43b25a610e42bf1e6e65
Source of Spectrum IY-1-4459-2
Wiley ID 1652575