| SpectraBase Compound ID | 6qXOisYqFd7 |
|---|---|
| InChI | InChI=1S/C16H13ClN2O2/c1-21-12-8-6-11(7-9-12)19-16(20)10-15(18-19)13-4-2-3-5-14(13)17/h2-10,20H,1H3 |
| InChIKey | WPXHEIKMGWHFMU-UHFFFAOYSA-N |
| Mol Weight | 300.75 g/mol |
| Molecular Formula | C16H13ClN2O2 |
| Exact Mass | 300.066555 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LFCvnGEXDn5 |
|---|---|
| Name | 1H-Pyrazol-5-ol, 3-(2-chlorophenyl)-1-(4-methoxyphenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 300.066555365 u |
| Formula | C16H13ClN2O2 |
| InChI | InChI=1S/C16H13ClN2O2/c1-21-12-8-6-11(7-9-12)19-16(20)10-15(18-19)13-4-2-3-5-14(13)17/h2-10,20H,1H3 |
| InChIKey | WPXHEIKMGWHFMU-UHFFFAOYSA-N |
| SMILES | OC=1N(N=C(C1)C=1C(Cl)=CC=CC1)C1=CC=C(C=C1)OC |