| SpectraBase Compound ID | Jf5K4lKT02E |
|---|---|
| InChI | InChI=1S/C11H12O3/c1-8(12)14-11(10-7-13-10)9-5-3-2-4-6-9/h2-6,10-11H,7H2,1H3/t10-,11-/m0/s1 |
| InChIKey | NWJRBDOPCDIZGN-QWRGUYRKSA-N |
| Mol Weight | 192.21 g/mol |
| Molecular Formula | C11H12O3 |
| Exact Mass | 192.078644 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 | djWvWTfVSM |
|---|---|
| Name | Acetic acid ANTI2,3-epoxy 1-phenyl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.078644243 u |
| Formula | C11H12O3 |
| InChI | InChI=1S/C11H12O3/c1-8(12)14-11(10-7-13-10)9-5-3-2-4-6-9/h2-6,10-11H,7H2,1H3/t10-,11-/m0/s1 |
| InChIKey | NWJRBDOPCDIZGN-QWRGUYRKSA-N |
| Molecular Weight | 192.214 g/mol |
| SMILES | C=1(C=CC=CC1)[C@@]([C@@]1(CO1)[H])(OC(C)=O)[H] |