| SpectraBase Compound ID | BbcW14C8YlL |
|---|---|
| InChI | InChI=1S/C9H21NO2/c1-3-5-10(6-4-2)7-9(12)8-11/h9,11-12H,3-8H2,1-2H3 |
| InChIKey | CTSOJEIWXYRSEM-UHFFFAOYSA-N |
| Mol Weight | 175.27 g/mol |
| Molecular Formula | C9H21NO2 |
| Exact Mass | 175.157229 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | AHzCx24buij |
|---|---|
| Name | 3-Dipropylamino-1,2-propanediol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 175.157228918 u |
| Formula | C9H21NO2 |
| InChI | InChI=1S/C9H21NO2/c1-3-5-10(6-4-2)7-9(12)8-11/h9,11-12H,3-8H2,1-2H3 |
| InChIKey | CTSOJEIWXYRSEM-UHFFFAOYSA-N |
| Molecular Weight | 175.272 g/mol |
| SMILES | C(CC)N(CC(CO)O)CCC |
| Spectrum/Structure Validation Score (Raman) | 0.98705 |