| SpectraBase Compound ID | HsyTLLkGAyy |
|---|---|
| InChI | InChI=1S/C16H13ClN2O2/c1-21-15-9-5-4-8-14(15)19-16(20)10-13(18-19)11-6-2-3-7-12(11)17/h2-10,20H,1H3 |
| InChIKey | QTHLQUCLRBVOJU-UHFFFAOYSA-N |
| Mol Weight | 300.75 g/mol |
| Molecular Formula | C16H13ClN2O2 |
| Exact Mass | 300.066555 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9sn4jatKnJW |
|---|---|
| Name | 1H-Pyrazol-5-ol, 3-(2-chlorophenyl)-1-(2-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/c1-21-15-9-5-4-8-14(15)19-16(20)10-13(18-19)11-6-2-3-7-12(11)17/h2-10,20H,1H3 |
| InChIKey | QTHLQUCLRBVOJU-UHFFFAOYSA-N |
| SMILES | OC=1N(N=C(C=2C(Cl)=CC=CC2)C1)C=1C(OC)=CC=CC1 |