| SpectraBase Compound ID | 4Sf8bPImzxg |
|---|---|
| InChI | InChI=1S/C12H17NO2/c14-10-4-7-12(15)13-9-8-11-5-2-1-3-6-11/h1-3,5-6,14H,4,7-10H2,(H,13,15) |
| InChIKey | LVFRVPDTAVRODL-UHFFFAOYSA-N |
| Mol Weight | 207.27 g/mol |
| Molecular Formula | C12H17NO2 |
| Exact Mass | 207.125929 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | KEVgMJ1d0My |
|---|---|
| Name | 4-Hydroxy-N-phenethylbutyramide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 207.125928789 u |
| Formula | C12H17NO2 |
| InChI | InChI=1S/C12H17NO2/c14-10-4-7-12(15)13-9-8-11-5-2-1-3-6-11/h1-3,5-6,14H,4,7-10H2,(H,13,15) |
| InChIKey | LVFRVPDTAVRODL-UHFFFAOYSA-N |
| Molecular Weight | 207.273 g/mol |
| SMILES | N(CCC1=CC=CC=C1)C(CCCO)=O |
| Spectrum/Structure Validation Score (Raman) | 0.989195 |