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4-(3,5-Dimethylpyrazol-1-yl)-N-(2-phenylethyl)benzamide
SpectraBase Compound ID GYg1Wc0IoIU
InChI InChI=1S/C20H21N3O/c1-15-14-16(2)23(22-15)19-10-8-18(9-11-19)20(24)21-13-12-17-6-4-3-5-7-17/h3-11,14H,12-13H2,1-2H3,(H,21,24)
InChIKey BXCYVQPKUQDECP-UHFFFAOYSA-N
Mol Weight 319.41 g/mol
Molecular Formula C20H21N3O
Exact Mass 319.168462 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8o0Bhxsd1BB
Name 4-(3,5-Dimethylpyrazol-1-yl)-N-(2-phenylethyl)benzamide
Comments Computed using HOSE algorithm
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Exact Mass 319.168462307 u
Formula C20H21N3O
InChI InChI=1S/C20H21N3O/c1-15-14-16(2)23(22-15)19-10-8-18(9-11-19)20(24)21-13-12-17-6-4-3-5-7-17/h3-11,14H,12-13H2,1-2H3,(H,21,24)
InChIKey BXCYVQPKUQDECP-UHFFFAOYSA-N
Molecular Weight 319.408 g/mol
SMILES C1=CC(=CC=C1C(NCCC1=CC=CC=C1)=O)N1C(=CC(=N1)C)C