SpectraBase Spectrum ID |
8MI6BP4W0PN |
Name |
(8R,8as)-8-Hydroxy-8-methyl-1,2,3,6,7,8A-hexahydroindolizin-5-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
169.110278725 u |
Formula |
C9H15NO2 |
InChI |
InChI=1S/C9H15NO2/c1-9(12)5-4-8(11)10-6-2-3-7(9)10/h7,12H,2-6H2,1H3/t7-,9+/m0/s1 |
InChIKey |
MLDPXHGIRJSRIL-IONNQARKSA-N |
Molecular Weight |
169.224 g/mol |
SMILES |
C1(N2[C@]([C@@](CC1)(O)C)(CCC2)[H])=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971529 |