| SpectraBase Compound ID | 9HP6RxYqWgi |
|---|---|
| InChI | InChI=1S/C16H21N3/c1-12-15(13-8-4-2-5-9-13)16(17)19(18-12)14-10-6-3-7-11-14/h2,4-5,8-9,14H,3,6-7,10-11,17H2,1H3 |
| InChIKey | BONOUDQPFOSBEM-UHFFFAOYSA-N |
| Mol Weight | 255.36 g/mol |
| Molecular Formula | C16H21N3 |
| Exact Mass | 255.173548 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fzo2tMVth6v |
|---|---|
| Name | Pyrazol-5-amine, 1-cyclohexyl-3-methyl-4-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 255.173547688 u |
| Formula | C16H21N3 |
| InChI | InChI=1S/C16H21N3/c1-12-15(13-8-4-2-5-9-13)16(17)19(18-12)14-10-6-3-7-11-14/h2,4-5,8-9,14H,3,6-7,10-11,17H2,1H3 |
| InChIKey | BONOUDQPFOSBEM-UHFFFAOYSA-N |
| Molecular Weight | 255.365 g/mol |
| SMILES | C=1(N(C2CCCCC2)N=C(C1C=1C=CC=CC1)C)N |