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(+)-2-/(3-{[(1'-cyclohexylethyl)methylamino]methyl}-1-pyrazolyl)/pyridine
SpectraBase Compound ID E2raCpPlEjQ
InChI InChI=1S/C18H26N4/c1-15(16-8-4-3-5-9-16)21(2)14-17-11-13-22(20-17)18-10-6-7-12-19-18/h6-7,10-13,15-16H,3-5,8-9,14H2,1-2H3
InChIKey MYBMANBZYMCNOH-UHFFFAOYSA-N
Mol Weight 298.43 g/mol
Molecular Formula C18H26N4
Exact Mass 298.215747 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KpncUmIGixU
Name (+)-2-/(3-{[(1'-cyclohexylethyl)methylamino]methyl}-1-pyrazolyl)/pyridine
Comments Computed using HOSE algorithm
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Exact Mass 298.215746853 u
Formula C18H26N4
InChI InChI=1S/C18H26N4/c1-15(16-8-4-3-5-9-16)21(2)14-17-11-13-22(20-17)18-10-6-7-12-19-18/h6-7,10-13,15-16H,3-5,8-9,14H2,1-2H3
InChIKey MYBMANBZYMCNOH-UHFFFAOYSA-N
SMILES C1(=NN(C=C1)C1=NC=CC=C1)CN(C(C1CCCCC1)C)C