| SpectraBase Spectrum ID |
1THfhvjEYza |
| Name |
[(1R,3 R)-3-Acetoxy-1,2,2-trimethylcyclopentyl]methylketone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
212.141244501 u |
| Formula |
C12H20O3 |
| InChI |
InChI=1S/C12H20O3/c1-8(13)12(5)7-6-10(11(12,3)4)15-9(2)14/h10H,6-7H2,1-5H3/t10-,12+/m1/s1 |
| InChIKey |
BSKJHVNLIKYSFP-PWSUYJOCSA-N |
| Molecular Weight |
212.289 g/mol |
| SMILES |
C(=O)(C)[C@]1(C([C@@](CC1)(OC(=O)C)[H])(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.983426 |
![[(1R,3 R)-3-Acetoxy-1,2,2-trimethylcyclopentyl]methylketone](/api/spectrum/1THfhvjEYza/structure.png?h=300&w=458 "[(1R,3 R)-3-Acetoxy-1,2,2-trimethylcyclopentyl]methylketone")
