| SpectraBase Spectrum ID |
JEKl4WbGLjc |
| Name |
1-Deoxy-1-(methylamino)-D-galactitol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
195.110672646 u |
| Formula |
C7H17NO5 |
| InChI |
InChI=1S/C7H17NO5/c1-8-2-4(10)6(12)7(13)5(11)3-9/h4-13H,2-3H2,1H3/t4-,5+,6+,7-/m0/s1 |
| InChIKey |
MBBZMMPHUWSWHV-WNJXEPBRSA-N |
| Molecular Weight |
195.215 g/mol |
| SMILES |
[C@]([C@@]([C@@](O)(CNC)[H])(O)[H])([C@](O)(CO)[H])(O)[H] |
| Spectrum/Structure Validation Score (Raman) |
0.846269 |
