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Acetamide, N-[5-methyl-1-(phenylmethyl)-1H-pyrazol-3-yl]-2-phenoxy-
SpectraBase Compound ID B6PR29FdC6L
InChI InChI=1S/C19H19N3O2/c1-15-12-18(21-22(15)13-16-8-4-2-5-9-16)20-19(23)14-24-17-10-6-3-7-11-17/h2-12H,13-14H2,1H3,(H,20,21,23)
InChIKey KXTFCWQNSBMHBG-UHFFFAOYSA-N
Mol Weight 321.38 g/mol
Molecular Formula C19H19N3O2
Exact Mass 321.147727 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IeCfSWGiuSB
Name Acetamide, N-[5-methyl-1-(phenylmethyl)-1H-pyrazol-3-yl]-2-phenoxy-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 321.147726862 u
Formula C19H19N3O2
InChI InChI=1S/C19H19N3O2/c1-15-12-18(21-22(15)13-16-8-4-2-5-9-16)20-19(23)14-24-17-10-6-3-7-11-17/h2-12H,13-14H2,1H3,(H,20,21,23)
InChIKey KXTFCWQNSBMHBG-UHFFFAOYSA-N
Molecular Weight 321.380 g/mol
SMILES C1=CC=C(C=C1)OCC(NC=1C=C(C)N(N1)CC1=CC=CC=C1)=O