| SpectraBase Spectrum ID |
2IdEXBKH8f9 |
| Name |
(+-)-1-epi-lentiginosine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
157.110278725 u |
| Formula |
C8H15NO2 |
| InChI |
InChI=1S/C8H15NO2/c10-7-5-9-4-2-1-3-6(9)8(7)11/h6-8,10-11H,1-5H2/t6-,7-,8+/m0/s1 |
| InChIKey |
SQECYPINZNWUTE-BIIVOSGPSA-N |
| Molecular Weight |
157.213 g/mol |
| SMILES |
[C@@]12(N(C[C@@]([C@@]2(O)[H])(O)[H])CCCC1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.896979 |
