| SpectraBase Spectrum ID |
4dxiX4fTWN4 |
| Name |
(-)-(1R)-2,2-dimethyl-3-ethylcyclopent-3-ene-1-ethyl acetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
210.161979946 u |
| Formula |
C13H22O2 |
| InChI |
InChI=1S/C13H22O2/c1-5-10-7-8-11(13(10,3)4)9-12(14)15-6-2/h7,11H,5-6,8-9H2,1-4H3/t11-/m1/s1 |
| InChIKey |
VMUTXDABBLCWQX-LLVKDONJSA-N |
| Molecular Weight |
210.317 g/mol |
| SMILES |
C1(C(=CC[C@@]1(CC(=O)OCC)[H])CC)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.904645 |
