| SpectraBase Spectrum ID |
4yxP1Qa0CYQ |
| Name |
Pyrrolidine, 1-(1-oxo-16-octadecenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
335.318814943 u |
| Formula |
C22H41NO |
| InChI |
InChI=1S/C22H41NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(24)23-20-17-18-21-23/h2-3H,4-21H2,1H3/b3-2+ |
| InChIKey |
OUOMRXXIBMVQHH-NSCUHMNNSA-N |
| Molecular Weight |
335.576 g/mol |
| SMILES |
C(C(=O)N1CCCC1)CCCCCCCCCCCCC\C=C\C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.872059 |
