| SpectraBase Compound ID | I1JSJQo84ag |
|---|---|
| InChI | InChI=1S/C16H14N2O3/c19-16(20-14-9-5-2-6-10-14)21-15-11-12-18(17-15)13-7-3-1-4-8-13/h1-10H,11-12H2 |
| InChIKey | JAVVXMRCWZLYMD-UHFFFAOYSA-N |
| Mol Weight | 282.3 g/mol |
| Molecular Formula | C16H14N2O3 |
| Exact Mass | 282.100442 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 | OLnCDX4AIT |
|---|---|
| Name | Carbonic acid, 4,5-dihydro-1-phenyl-1H-pyrazol-3-yl phenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.100442316 u |
| Formula | C16H14N2O3 |
| InChI | InChI=1S/C16H14N2O3/c19-16(20-14-9-5-2-6-10-14)21-15-11-12-18(17-15)13-7-3-1-4-8-13/h1-10H,11-12H2 |
| InChIKey | JAVVXMRCWZLYMD-UHFFFAOYSA-N |
| SMILES | C(=O)(OC1=NN(C2=CC=CC=C2)CC1)OC1=CC=CC=C1 |