| SpectraBase Spectrum ID |
9VK3FZjVg2Q |
| Name |
5-(Pentanoyl)-8-butyl-6,7-dehydroindolizidine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
263.224914557 u |
| Formula |
C17H29NO |
| InChI |
InChI=1S/C17H29NO/c1-3-5-8-14-11-12-16(17(19)10-6-4-2)18-13-7-9-15(14)18/h11-12,14-16H,3-10,13H2,1-2H3 |
| InChIKey |
SFTADUWEMPWTQI-UHFFFAOYSA-N |
| Molecular Weight |
263.425 g/mol |
| SMILES |
C1(N2C(C(C=C1)CCCC)CCC2)C(=O)CCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.811354 |