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5-tert-butyl-1-(3-chlorobenzoyl)-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol
SpectraBase Compound ID K6xeR3Kfj3B
InChI InChI=1S/C15H16ClF3N2O2/c1-13(2,3)14(23)8-11(15(17,18)19)20-21(14)12(22)9-5-4-6-10(16)7-9/h4-7,23H,8H2,1-3H3
InChIKey NBOSOHNFWGCTQS-UHFFFAOYSA-N
Mol Weight 348.75 g/mol
Molecular Formula C15H16ClF3N2O2
Exact Mass 348.08524 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LxpIUiE2BWg
Name 5-tert-Butyl-1-(3-chlorobenzoyl)-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol
CAS Registry Number 303133-49-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16ClF3N2O2
InChI InChI=1S/C15H16ClF3N2O2/c1-13(2,3)14(23)8-11(15(17,18)19)20-21(14)12(22)9-5-4-6-10(16)7-9/h4-7,23H,8H2,1-3H3
InChIKey NBOSOHNFWGCTQS-UHFFFAOYSA-N
Molecular Weight 348.753 g/mol
SMILES OC1(CC(=NN1C(c1cccc(c1)Cl)=O)C(F)(F)F)C(C)(C)C
SPLASH splash10-000l-5900000000-62020eddc86fefe9fa15
Source of Spectrum AD-0-2532-0
Synonyms 2-Pyrazolin-5-ol, 5-tert-butyl-1-(3-chlorobenzoyl)-3-trifluoromethyl- [5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-2-pyrazolin-1-yl]-(3-chlorophenyl)methanone [5-tert-butyl-5-hydroxy-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(3-chlorophenyl)methanone [5-tert-butyl-5-oxidanyl-3-(trifluoromethyl)-4H-pyrazol-1-yl]-(3-chlorophenyl)methanone
Wiley ID 1425767