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2-{[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)amino]carbonyl}cyclohexanecarboxylic acid
SpectraBase Compound ID 7lRG2ILI7Xt
InChI InChI=1S/C15H23N3O3/c1-4-18-10(3)13(9(2)17-18)16-14(19)11-7-5-6-8-12(11)15(20)21/h11-12H,4-8H2,1-3H3,(H,16,19)(H,20,21)
InChIKey SBUSIAGUGPQSRP-UHFFFAOYSA-N
Mol Weight 293.37 g/mol
Molecular Formula C15H23N3O3
Exact Mass 293.173942 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gm67hDRMBp0
Name 2-{[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)amino]carbonyl}cyclohexanecarboxylic acid
Comments Computed using HOSE algorithm
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Exact Mass 293.173941610 u
Formula C15H23N3O3
InChI InChI=1S/C15H23N3O3/c1-4-18-10(3)13(9(2)17-18)16-14(19)11-7-5-6-8-12(11)15(20)21/h11-12H,4-8H2,1-3H3,(H,16,19)(H,20,21)
InChIKey SBUSIAGUGPQSRP-UHFFFAOYSA-N
Molecular Weight 293.367 g/mol
SMILES N(C1=C(N(CC)N=C1C)C)C(C1C(C(=O)O)CCCC1)=O