| SpectraBase Compound ID | PtUR3gx5ti |
|---|---|
| InChI | InChI=1S/C11H15NO2/c1-8(12)11(14-9(2)13)10-6-4-3-5-7-10/h3-8,11H,12H2,1-2H3/t8?,11-/m0/s1 |
| InChIKey | HUNZRUDHAMRFMA-LYNSQETBSA-N |
| Mol Weight | 193.25 g/mol |
| Molecular Formula | C11H15NO2 |
| Exact Mass | 193.110279 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Au08zjmeumA |
|---|---|
| Name | Norephedrine o-ac |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 193.110278725 u |
| Formula | C11H15NO2 |
| InChI | InChI=1S/C11H15NO2/c1-8(12)11(14-9(2)13)10-6-4-3-5-7-10/h3-8,11H,12H2,1-2H3/t8?,11-/m0/s1 |
| InChIKey | HUNZRUDHAMRFMA-LYNSQETBSA-N |
| Molecular Weight | 193.246 g/mol |
| SMILES | [C@](C1=CC=CC=C1)(C(N)C)(OC(=O)C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.946614 |