| SpectraBase Compound ID | 9FpBv0lmhiB |
|---|---|
| InChI | InChI=1S/C16H31NO2/c1-2-3-4-5-6-7-8-11-15(18)14-16(19)17-12-9-10-13-17/h15,18H,2-14H2,1H3 |
| InChIKey | VPHNSZDABAFKLO-UHFFFAOYSA-N |
| Mol Weight | 269.43 g/mol |
| Molecular Formula | C16H31NO2 |
| Exact Mass | 269.235479 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5StgBglxlV7 |
|---|---|
| Name | 3-Hydroxy-dodecanoic acid, pyrrolidide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.235479240 u |
| Formula | C16H31NO2 |
| InChI | InChI=1S/C16H31NO2/c1-2-3-4-5-6-7-8-11-15(18)14-16(19)17-12-9-10-13-17/h15,18H,2-14H2,1H3 |
| InChIKey | VPHNSZDABAFKLO-UHFFFAOYSA-N |
| SMILES | C1N(CCC1)C(CC(CCCCCCCCC)O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.87735 |