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3-oxo-2-{[(pyrazol-5-yl)amino]methylene}hexanoic acid, ethyl ester
SpectraBase Compound ID FfupF5qoOkg
InChI InChI=1S/C12H17N3O3/c1-3-5-10(16)9(12(17)18-4-2)8-13-11-6-7-14-15-11/h6-8H,3-5H2,1-2H3,(H2,13,14,15)
InChIKey ARVXSDRADCLNMW-UHFFFAOYSA-N
Mol Weight 251.29 g/mol
Molecular Formula C12H17N3O3
Exact Mass 251.126991 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3iH1NkNS2we
Name 3-OXO-2-{[(PYRAZOL-5-YL)AMINO]METHYLENE}HEXANOIC ACID, ETHYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17N3O3
InChI InChI=1S/C12H17N3O3/c1-3-5-10(16)9(12(17)18-4-2)8-13-11-6-7-14-15-11/h6-8H,3-5H2,1-2H3,(H2,13,14,15)
InChIKey ARVXSDRADCLNMW-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 32-35C
Molecular Weight 251.29
Solvent CDCl3; Reference=TMS; Temperature 297K