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cyclohexanecarboxylic acid, 2-[[(1-methyl-1H-pyrazol-3-yl)amino]carbonyl]-

View entire compound with spectra: 2 NMR

cyclohexanecarboxylic acid, 2-[[(1-methyl-1H-pyrazol-3-yl)amino]carbonyl]-
SpectraBase Compound ID KPv30TRoZAF
InChI InChI=1S/C12H17N3O3/c1-15-7-6-10(14-15)13-11(16)8-4-2-3-5-9(8)12(17)18/h6-9H,2-5H2,1H3,(H,17,18)(H,13,14,16)
InChIKey YKWHBTHUYYRIOZ-UHFFFAOYSA-N
Mol Weight 251.29 g/mol
Molecular Formula C12H17N3O3
Exact Mass 251.126991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F8Ew9gLiDmZ
Name Cyclohexanecarboxylic acid, 2-[[(1-methyl-1H-pyrazol-3-yl)amino]carbonyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 251.126991416 u
Formula C12H17N3O3
InChI InChI=1S/C12H17N3O3/c1-15-7-6-10(14-15)13-11(16)8-4-2-3-5-9(8)12(17)18/h6-9H,2-5H2,1H3,(H,17,18)(H,13,14,16)
InChIKey YKWHBTHUYYRIOZ-UHFFFAOYSA-N
Molecular Weight 251.286 g/mol
SMILES OC(C1C(C(=O)NC2=NN(C=C2)C)CCCC1)=O