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acetamide, N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-2-(2-methoxyphenoxy)-
SpectraBase Compound ID KX3UALRGqdF
InChI InChI=1S/C20H21N3O4/c1-14-19(20(25)23(22(14)2)15-9-5-4-6-10-15)21-18(24)13-27-17-12-8-7-11-16(17)26-3/h4-12H,13H2,1-3H3,(H,21,24)
InChIKey XKSNBHYLEPWWTO-UHFFFAOYSA-N
Mol Weight 367.41 g/mol
Molecular Formula C20H21N3O4
Exact Mass 367.153206 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Iw2I386Uas2
Name Acetamide, N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-2-(2-methoxyphenoxy)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 367.153206164 u
Formula C20H21N3O4
InChI InChI=1S/C20H21N3O4/c1-14-19(20(25)23(22(14)2)15-9-5-4-6-10-15)21-18(24)13-27-17-12-8-7-11-16(17)26-3/h4-12H,13H2,1-3H3,(H,21,24)
InChIKey XKSNBHYLEPWWTO-UHFFFAOYSA-N
Molecular Weight 367.405 g/mol
SMILES N(C=1C(N(C=2C=CC=CC2)N(C1C)C)=O)C(=O)COC=1C(OC)=CC=CC1