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RAC-1-CYANOACETYL-5-HYDROXY-3-ETHYL-5-TRIFLUOROMETHYL-4,5-DIHYDRO-1H-PYRAZOLE
SpectraBase Compound ID 1tNnBh04JWT
InChI InChI=1S/C9H10F3N3O2/c1-2-6-5-8(17,9(10,11)12)15(14-6)7(16)3-4-13/h17H,2-3,5H2,1H3
InChIKey UGNOUERJZGHMBN-UHFFFAOYSA-N
Mol Weight 249.19 g/mol
Molecular Formula C9H10F3N3O2
Exact Mass 249.072511 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 64GMW5aH55W
Name 1-(Cyanoacetyl)-5-hydroxy-5-(trifluoromethyl)-3-ethyl-4,5-dihydro-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10F3N3O2
InChI InChI=1S/C9H10F3N3O2/c1-2-6-5-8(17,9(10,11)12)15(14-6)7(16)3-4-13/h17H,2-3,5H2,1H3
InChIKey UGNOUERJZGHMBN-UHFFFAOYSA-N
Molecular Weight 249.193 g/mol
SMILES OC1(N(N=C(C1)CC)C(CC#N)=O)C(F)(F)F
SPLASH splash10-03di-1900000000-c3a713e20242bc4ed6f3
Source of Spectrum D9-19-1365-5c
Synonyms 3-[3-ethyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-3-oxopropanenitrile 3-[3-ethyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-3-oxo-propanenitrile 3-[3-ethyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-3-oxidanylidene-propanenitrile
Wiley ID 1695352