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Benzamide, N-[2-(3-fluorophenyl)-5-methyl-2H-pyrazol-3-yl]-2-methoxy-
SpectraBase Compound ID 9ZcmB34vacZ
InChI InChI=1S/C18H16FN3O2/c1-12-10-17(22(21-12)14-7-5-6-13(19)11-14)20-18(23)15-8-3-4-9-16(15)24-2/h3-11H,1-2H3,(H,20,23)
InChIKey BRBDFVJPMYBPJH-UHFFFAOYSA-N
Mol Weight 325.34 g/mol
Molecular Formula C18H16FN3O2
Exact Mass 325.122655 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7eyt09lBVev
Name Benzamide, N-[2-(3-fluorophenyl)-5-methyl-2H-pyrazol-3-yl]-2-methoxy-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 325.122654928 u
Formula C18H16FN3O2
InChI InChI=1S/C18H16FN3O2/c1-12-10-17(22(21-12)14-7-5-6-13(19)11-14)20-18(23)15-8-3-4-9-16(15)24-2/h3-11H,1-2H3,(H,20,23)
InChIKey BRBDFVJPMYBPJH-UHFFFAOYSA-N
Molecular Weight 325.343 g/mol
SMILES C1(=C(C=CC=C1)OC)C(NC=1N(C2=CC=CC(=C2)F)N=C(C1)C)=O