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1H-Pyrazole-1-acetic acid, 3,5-dimethyl-4-[[2-(4-methylphenoxy)acetyl]amino]-, ethyl ester

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1H-Pyrazole-1-acetic acid, 3,5-dimethyl-4-[[2-(4-methylphenoxy)acetyl]amino]-, ethyl ester
SpectraBase Compound ID C8wkzcW8zpH
InChI InChI=1S/C18H23N3O4/c1-5-24-17(23)10-21-14(4)18(13(3)20-21)19-16(22)11-25-15-8-6-12(2)7-9-15/h6-9H,5,10-11H2,1-4H3,(H,19,22)
InChIKey GKSBXXBONJSYTB-UHFFFAOYSA-N
Mol Weight 345.4 g/mol
Molecular Formula C18H23N3O4
Exact Mass 345.168856 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JFYI773yPlI
Name 1H-Pyrazole-1-acetic acid, 3,5-dimethyl-4-[[2-(4-methylphenoxy)acetyl]amino]-, ethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 345.168856229 u
Formula C18H23N3O4
InChI InChI=1S/C18H23N3O4/c1-5-24-17(23)10-21-14(4)18(13(3)20-21)19-16(22)11-25-15-8-6-12(2)7-9-15/h6-9H,5,10-11H2,1-4H3,(H,19,22)
InChIKey GKSBXXBONJSYTB-UHFFFAOYSA-N
Molecular Weight 345.399 g/mol
SMILES CCOC(CN1N=C(C)C(=C1C)NC(=O)COC=1C=CC(C)=CC1)=O