| SpectraBase Spectrum ID |
EglfwNvziwz |
| Name |
Pipecolic acid, N-octyloxycarbonyl-, octyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
397.319208865 u |
| Formula |
C23H43NO4 |
| InChI |
InChI=1S/C23H43NO4/c1-3-5-7-9-11-15-19-27-22(25)21-17-13-14-18-24(21)23(26)28-20-16-12-10-8-6-4-2/h21H,3-20H2,1-2H3 |
| InChIKey |
LASKFZJULSTHDD-UHFFFAOYSA-N |
| Molecular Weight |
397.600 g/mol |
| SMILES |
C1CCN(C(C1)C(OCCCCCCCC)=O)C(OCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.850682 |
