| SpectraBase Spectrum ID |
6ys5xz4dRDY |
| Name |
2,9-Dimethyl-4-ethyl-trans-decahydroquinol-4-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
211.193614428 u |
| Formula |
C13H25NO |
| InChI |
InChI=1S/C13H25NO/c1-4-13(15)9-10(2)14-12(3)8-6-5-7-11(12)13/h10-11,14-15H,4-9H2,1-3H3 |
| InChIKey |
PTMWLQMYCUNWBG-UHFFFAOYSA-N |
| Molecular Weight |
211.349 g/mol |
| SMILES |
C12(C(C(O)(CC)CC(N2)C)CCCC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.939015 |
