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1-(Cyanoacetyl)-5-hydroxy-4-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazole

View entire compound with spectra: 2 NMR, and 1 MS (GC)

1-(Cyanoacetyl)-5-hydroxy-4-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazole
SpectraBase Compound ID HGTXFu7TfdK
InChI InChI=1S/C8H8F3N3O2/c1-5-4-13-14(6(15)2-3-12)7(5,16)8(9,10)11/h4-5,16H,2H2,1H3
InChIKey OSYKYNXXZHASGW-UHFFFAOYSA-N
Mol Weight 235.17 g/mol
Molecular Formula C8H8F3N3O2
Exact Mass 235.056861 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JrluSu8o0Td
Name 1-(Cyanoacetyl)-5-hydroxy-4-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8F3N3O2
InChI InChI=1S/C8H8F3N3O2/c1-5-4-13-14(6(15)2-3-12)7(5,16)8(9,10)11/h4-5,16H,2H2,1H3
InChIKey OSYKYNXXZHASGW-UHFFFAOYSA-N
Molecular Weight 235.166 g/mol
SMILES OC1(N(N=CC1C)C(CC#N)=O)C(F)(F)F
SPLASH splash10-0002-9100000000-2b74a0787ad16d713ac0
Source of Spectrum AH-139-1053-5e
Wiley ID 1695755