| SpectraBase Spectrum ID |
13iohuGmwKz |
| Name |
(S)-N-Dodecyl-4-chloro-3-hydroxybutyramide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
305.212156972 u |
| Formula |
C16H32ClNO2 |
| InChI |
InChI=1S/C16H32ClNO2/c1-2-3-4-5-6-7-8-9-10-11-12-18-16(20)13-15(19)14-17/h15,19H,2-14H2,1H3,(H,18,20)/t15-/m0/s1 |
| InChIKey |
HVCSXLFVZJDMBM-HNNXBMFYSA-N |
| Molecular Weight |
305.890 g/mol |
| SMILES |
C(C[C@](O)(CCl)[H])(=O)NCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.844219 |
