| SpectraBase Compound ID | Ja9KpcB4KlT |
|---|---|
| InChI | InChI=1S/C12H15NO3/c1-2-9-5-3-4-6-11(9)13-12(14)16-8-10-7-15-10/h3-6,10H,2,7-8H2,1H3,(H,13,14) |
| InChIKey | AIPWCECSEFVOGL-UHFFFAOYSA-N |
| Mol Weight | 221.26 g/mol |
| Molecular Formula | C12H15NO3 |
| Exact Mass | 221.105193 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4MJ4l3B8OHJ |
|---|---|
| Name | Carbamic acid, N-(2-ethylphenyl)-, oxiranylmethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.105193344 u |
| Formula | C12H15NO3 |
| InChI | InChI=1S/C12H15NO3/c1-2-9-5-3-4-6-11(9)13-12(14)16-8-10-7-15-10/h3-6,10H,2,7-8H2,1H3,(H,13,14) |
| InChIKey | AIPWCECSEFVOGL-UHFFFAOYSA-N |
| Molecular Weight | 221.256 g/mol |
| SMILES | C1=CC=C(C(=C1)CC)NC(OCC1OC1)=O |