| SpectraBase Spectrum ID |
HF9Pmhdc7OP |
| Name |
(2R,3R)-Spiro[2,3-dimethyl-1,4-dioxolane-5,1'-3'-cyanocyclohexane] |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
209.141578854 u |
| Formula |
C12H19NO2 |
| InChI |
InChI=1S/C12H19NO2/c1-9-10(2)15-12(14-9)6-4-5-11(3,7-12)8-13/h9-10H,4-7H2,1-3H3/t9-,10-,11-/m1/s1 |
| InChIKey |
BYQYTQZVYLESDZ-GMTAPVOTSA-N |
| Molecular Weight |
209.289 g/mol |
| SMILES |
C12(O[C@](C)([C@](O2)(C)[H])[H])C[C@@](C#N)(C)CCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.900799 |
![(2R,3R)-spiro[2,3-dimethyl-1,4-dioxolane-5,1'-3'-cyanocyclohexane]](/api/spectrum/HF9Pmhdc7OP/structure.png?h=300&w=458 "(2R,3R)-spiro[2,3-dimethyl-1,4-dioxolane-5,1'-3'-cyanocyclohexane]")
