| SpectraBase Spectrum ID |
3rpPPyJq1lT |
| Name |
(1.beta.,4.beta.,7.beta.,8.beta.,9.alpha.)-3-Ethyl-1-methyl-3-azatricyclo[5.4.0.0(4,8)]undecan-9-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
209.177964364 u |
| Formula |
C13H23NO |
| InChI |
InChI=1S/C13H23NO/c1-3-14-8-13(2)7-6-11(15)12-9(13)4-5-10(12)14/h9-12,15H,3-8H2,1-2H3/t9-,10-,11-,12-,13-/m0/s1 |
| InChIKey |
UPOGYRUXCHZSFM-VLJOUNFMSA-N |
| Molecular Weight |
209.333 g/mol |
| SMILES |
[C@@]12(N(C[C@@]3(CC[C@@]([C@]2([C@]3([H])CC1)[H])(O)[H])C)CC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.899964 |
![(1.beta.,4.beta.,7.beta.,8.beta.,9.alpha.)-3-Ethyl-1-methyl-3-azatricyclo[5.4.0.0(4,8)]undecan-9-ol](/api/spectrum/3rpPPyJq1lT/structure.png?h=300&w=458 "(1.beta.,4.beta.,7.beta.,8.beta.,9.alpha.)-3-Ethyl-1-methyl-3-azatricyclo[5.4.0.0(4,8)]undecan-9-ol")
