| SpectraBase Spectrum ID |
gtSX3Pfhve |
| Name |
(1R,3S)-3-Amino-2,2-dimethylcyclobutylmethanol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
129.115364106 u |
| Formula |
C7H15NO |
| InChI |
InChI=1S/C7H15NO/c1-7(2)5(4-9)3-6(7)8/h5-6,9H,3-4,8H2,1-2H3/t5-,6-/m0/s1 |
| InChIKey |
YQMFPAGMJRXYRQ-WDSKDSINSA-N |
| Molecular Weight |
129.203 g/mol |
| SMILES |
C1([C@@](N)(C[C@]1(CO)[H])[H])(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.927204 |
