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2H-Benzopyrazol-3-ol, 3,3a,4,5,6,7-hexahydro-2-(3-methoxybenzoyl)-3-trifluoromethyl-
SpectraBase Compound ID AKPfFP2Rk3D
InChI InChI=1S/C16H17F3N2O3/c1-24-11-6-4-5-10(9-11)14(22)21-15(23,16(17,18)19)12-7-2-3-8-13(12)20-21/h4-6,9,12,23H,2-3,7-8H2,1H3
InChIKey QLOFJRJIVNIGEZ-UHFFFAOYSA-N
Mol Weight 342.32 g/mol
Molecular Formula C16H17F3N2O3
Exact Mass 342.119127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CF3D9zmKmk7
Name 2H-Benzopyrazol-3-ol, 3,3a,4,5,6,7-hexahydro-2-(3-methoxybenzoyl)-3-trifluoromethyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17F3N2O3
InChI InChI=1S/C16H17F3N2O3/c1-24-11-6-4-5-10(9-11)14(22)21-15(23,16(17,18)19)12-7-2-3-8-13(12)20-21/h4-6,9,12,23H,2-3,7-8H2,1H3
InChIKey QLOFJRJIVNIGEZ-UHFFFAOYSA-N
Molecular Weight 342.318 g/mol
SMILES OC1(C2C(=NN1C(c1cccc(c1)OC)=O)CCCC2)C(F)(F)F
SPLASH splash10-000i-4900000000-513b83b71fa7ec9d741c
Source of Spectrum AD-0-2532-0
Synonyms (3-methoxyphenyl)-[3-oxidanyl-3-(trifluoromethyl)-4,5,6,7-tetrahydro-3aH-indazol-2-yl]methanone 2-(3-Methoxybenzoyl)-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-3-ol [3-hydroxy-3-(trifluoromethyl)-4,5,6,7-tetrahydro-3aH-indazol-2-yl]-(3-methoxyphenyl)methanone
Wiley ID 1420888