| SpectraBase Compound ID | DXxfhpHoSxr |
|---|---|
| InChI | InChI=1S/C7H13NO/c1-6(9)7-4-3-5-8(7)2/h7H,3-5H2,1-2H3 |
| InChIKey | XIJAMIYSOKUWSX-UHFFFAOYSA-N |
| Mol Weight | 127.19 g/mol |
| Molecular Formula | C7H13NO |
| Exact Mass | 127.099714 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 8O56WOw0HMr |
|---|---|
| Name | Poly(proline) |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 127.099714042 u |
| Formula | C7H13NO |
| InChI | InChI=1S/C7H13NO/c1-6(9)7-4-3-5-8(7)2/h7H,3-5H2,1-2H3 |
| InChIKey | XIJAMIYSOKUWSX-UHFFFAOYSA-N |
| Molecular Weight | 127.187 g/mol |
| Nominal Mass | 127 u |
| SMILES | C1N(C(CC1)C(C)=O)C |
| Spectrum/Structure Validation Score (Raman) | 0.983539 |