| SpectraBase Compound ID | 714t0GHS3Hh |
|---|---|
| InChI | InChI=1S/C11H10N2O2/c1-15-11-5-8(2-3-10(11)14)4-9(6-12)7-13/h2-3,5,9,14H,4H2,1H3 |
| InChIKey | SICXLFPWQVDSCQ-UHFFFAOYSA-N |
| Mol Weight | 202.21 g/mol |
| Molecular Formula | C11H10N2O2 |
| Exact Mass | 202.074228 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1RBhUmapPuT |
|---|---|
| Name | 2-(4-Hydroxy-3-methoxybenzyl)malononitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 202.074227568 u |
| Formula | C11H10N2O2 |
| InChI | InChI=1S/C11H10N2O2/c1-15-11-5-8(2-3-10(11)14)4-9(6-12)7-13/h2-3,5,9,14H,4H2,1H3 |
| InChIKey | SICXLFPWQVDSCQ-UHFFFAOYSA-N |
| Molecular Weight | 202.213 g/mol |
| SMILES | C(C(C#N)CC=1C=C(C(=CC1)O)OC)#N |