| SpectraBase Spectrum ID |
BO2g7YLArVe |
| Name |
(1R*,3R*,6R*,11S*,12S*)-12-Chloro-11-methyl-2-oxatricyclo[6.3.1.0(2,6)]dodecane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
214.112442931 u |
| Formula |
C12H19ClO |
| InChI |
InChI=1S/C12H19ClO/c1-8-7-12-6-2-3-9(12)4-5-10(14-12)11(8)13/h8-11H,2-7H2,1H3/t8-,9+,10-,11-,12-/m0/s1 |
| InChIKey |
CZNPRHBVCDUBAY-OSUNSFLBSA-N |
| Molecular Weight |
214.736 g/mol |
| SMILES |
[C@]123O[C@@](CC[C@]3(CCC1)[H])([C@]([C@](C2)(C)[H])(Cl)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.823792 |
![(1R*,3R*,6R*,11S*,12S*)-12-Chloro-11-methyl-2-oxatricyclo[6.3.1.0(2,6)]dodecane](/api/spectrum/BO2g7YLArVe/structure.png?h=300&w=458 "(1R*,3R*,6R*,11S*,12S*)-12-Chloro-11-methyl-2-oxatricyclo[6.3.1.0(2,6)]dodecane")
