| SpectraBase Compound ID | JRJ0002s3TG |
|---|---|
| InChI | InChI=1S/C4H11NO2/c1-5-2-4(7)3-6/h4-7H,2-3H2,1H3 |
| InChIKey | WOMTYMDHLQTCHY-UHFFFAOYSA-N |
| Mol Weight | 105.14 g/mol |
| Molecular Formula | C4H11NO2 |
| Exact Mass | 105.078979 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | FOaSIys4VLY |
|---|---|
| Name | 1,2-Propanediol, 3-(methylamino)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 105.078978596 u |
| Formula | C4H11NO2 |
| InChI | InChI=1S/C4H11NO2/c1-5-2-4(7)3-6/h4-7H,2-3H2,1H3 |
| InChIKey | WOMTYMDHLQTCHY-UHFFFAOYSA-N |
| SMILES | N(C)CC(CO)O |
| Spectrum/Structure Validation Score (Raman) | 0.972451 |