| SpectraBase Spectrum ID |
9sMRnYtXavM |
| Name |
4,6-Dioxatricyclo[3.3.1.02,7]nonane-1-carbonitrile, 3,3-dimethyl-, (1R)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
179.094628661 u |
| Formula |
C10H13NO2 |
| InChI |
InChI=1S/C10H13NO2/c1-9(2)8-6-3-10(8,5-11)4-7(12-6)13-9/h6-8H,3-4H2,1-2H3/t6?,7?,8?,10-/m0/s1 |
| InChIKey |
GPABVPZHLIBZCK-RKSFOETPSA-N |
| Molecular Weight |
179.219 g/mol |
| SMILES |
[C@@]12(C3C(C)(C)OC(C2)OC3C1)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955946 |
![4,6-Dioxatricyclo[3.3.1.02,7]nonane-1-carbonitrile, 3,3-dimethyl-, (1R)-](/api/spectrum/9sMRnYtXavM/structure.png?h=300&w=458 "4,6-Dioxatricyclo[3.3.1.02,7]nonane-1-carbonitrile, 3,3-dimethyl-, (1R)-")
