| SpectraBase Spectrum ID |
13WjS6MIhDy |
| Name |
8-Methyl-5-[sec-hydroxy-(Z)-nonenyl]-indolizidine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
279.256214686 u |
| Formula |
C18H33NO |
| InChI |
InChI=1S/C18H33NO/c1-15-12-13-17(19-14-8-11-18(15)19)10-7-5-3-4-6-9-16(2)20/h6,9,15-18,20H,3-5,7-8,10-14H2,1-2H3/b9-6+ |
| InChIKey |
ZKBIKSXDRZXXPX-RMKNXTFCSA-N |
| Molecular Weight |
279.468 g/mol |
| SMILES |
C12N(C(CCC2C)CCCCC\C=C\C(O)C)CCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937396 |