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1H-pyrazol-5-ol, 4,5-dihydro-1-(2-hydroxybenzoyl)-3-(4-methoxyphenyl)-5-(trifluoromethyl)-

View entire compound with spectra: 2 NMR

1H-pyrazol-5-ol, 4,5-dihydro-1-(2-hydroxybenzoyl)-3-(4-methoxyphenyl)-5-(trifluoromethyl)-
SpectraBase Compound ID A3bsH8Huu69
InChI InChI=1S/C18H15F3N2O4/c1-27-12-8-6-11(7-9-12)14-10-17(26,18(19,20)21)23(22-14)16(25)13-4-2-3-5-15(13)24/h2-9,24,26H,10H2,1H3
InChIKey ZPADGBOHJJEDJV-UHFFFAOYSA-N
Mol Weight 380.32 g/mol
Molecular Formula C18H15F3N2O4
Exact Mass 380.098391 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ImwZ733GkUA
Name 1H-Pyrazol-5-ol, 4,5-dihydro-1-(2-hydroxybenzoyl)-3-(4-methoxyphenyl)-5-(trifluoromethyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 380.098391456 u
Formula C18H15F3N2O4
InChI InChI=1S/C18H15F3N2O4/c1-27-12-8-6-11(7-9-12)14-10-17(26,18(19,20)21)23(22-14)16(25)13-4-2-3-5-15(13)24/h2-9,24,26H,10H2,1H3
InChIKey ZPADGBOHJJEDJV-UHFFFAOYSA-N
Molecular Weight 380.323 g/mol
SMILES OC1(N(C(C2=C(C=CC=C2)O)=O)N=C(C1)C1=CC=C(C=C1)OC)C(F)(F)F