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Carbamic acid, N-methyl-N-phenyl-, 4,5-dihydro-1-phenyl-1H-pyrazol-3-yl ester
SpectraBase Compound ID IIL2aH2byi7
InChI InChI=1S/C17H17N3O2/c1-19(14-8-4-2-5-9-14)17(21)22-16-12-13-20(18-16)15-10-6-3-7-11-15/h2-11H,12-13H2,1H3
InChIKey SMSUJUUHLNBLEN-UHFFFAOYSA-N
Mol Weight 295.34 g/mol
Molecular Formula C17H17N3O2
Exact Mass 295.132077 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IbA6lbP7VXr
Name Carbamic acid, N-methyl-N-phenyl-, 4,5-dihydro-1-phenyl-1H-pyrazol-3-yl ester
Comments Computed using HOSE algorithm
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Exact Mass 295.132076797 u
Formula C17H17N3O2
InChI InChI=1S/C17H17N3O2/c1-19(14-8-4-2-5-9-14)17(21)22-16-12-13-20(18-16)15-10-6-3-7-11-15/h2-11H,12-13H2,1H3
InChIKey SMSUJUUHLNBLEN-UHFFFAOYSA-N
Molecular Weight 295.342 g/mol
SMILES CN(C(=O)OC1=NN(C2=CC=CC=C2)CC1)C1=CC=CC=C1