| SpectraBase Compound ID | EJhKU6Ij7gC |
|---|---|
| InChI | InChI=1S/C10H11NO3/c11-5-8-3-1-2-4-10(8)14-7-9(13)6-12/h1-4,9,12-13H,6-7H2/t9-/m0/s1 |
| InChIKey | GFPFQGFERWRLRO-VIFPVBQESA-N |
| Mol Weight | 193.2 g/mol |
| Molecular Formula | C10H11NO3 |
| Exact Mass | 193.073893 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 | 2aPujKKMyTI |
|---|---|
| Name | (2S)-1-(2-Cyanophenoxy)-2,3-propanediol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 193.073893215 u |
| Formula | C10H11NO3 |
| InChI | InChI=1S/C10H11NO3/c11-5-8-3-1-2-4-10(8)14-7-9(13)6-12/h1-4,9,12-13H,6-7H2/t9-/m0/s1 |
| InChIKey | GFPFQGFERWRLRO-VIFPVBQESA-N |
| Molecular Weight | 193.202 g/mol |
| SMILES | C(#N)C=1C(OC[C@@](O)(CO)[H])=CC=CC1 |