| SpectraBase Spectrum ID |
F9RpNYRri1I |
| Name |
(3R,6R)-Linalool oxide acetate |
| 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/c1-6-12(5)8-7-10(14-9(2)13)11(3,4)15-12/h6,10H,1,7-8H2,2-5H3/t10-,12+/m1/s1 |
| InChIKey |
IRWLDXUJBJPFNV-PWSUYJOCSA-N |
| Molecular Weight |
212.289 g/mol |
| SMILES |
C1(C)(O[C@](CC[C@]1(OC(C)=O)[H])(C=C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.979849 |
