| SpectraBase Compound ID | 1m1nVYhk435 |
|---|---|
| InChI | InChI=1S/C11H11NO3/c1-8(13)15-11(7-12)9-3-5-10(14-2)6-4-9/h3-6,11H,1-2H3/t11-/m0/s1 |
| InChIKey | IVJAHTMZHLEDFC-NSHDSACASA-N |
| Mol Weight | 205.21 g/mol |
| Molecular Formula | C11H11NO3 |
| Exact Mass | 205.073893 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 | BpHDAg2C6nJ |
|---|---|
| Name | (R)-(+-2-acetoxy-2-(4-methoxyphenyl)acetonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 205.073893215 u |
| Formula | C11H11NO3 |
| InChI | InChI=1S/C11H11NO3/c1-8(13)15-11(7-12)9-3-5-10(14-2)6-4-9/h3-6,11H,1-2H3/t11-/m0/s1 |
| InChIKey | IVJAHTMZHLEDFC-NSHDSACASA-N |
| Molecular Weight | 205.213 g/mol |
| SMILES | C(#N)[C@](OC(=O)C)(C1=CC=C(C=C1)OC)[H] |