| SpectraBase Spectrum ID |
9gCFWTdXnFr |
| Name |
(3R,3ar)-1,2,3,4,5,6-Hexahydro-3-methyl-6-oxo-3ah-indene-3A-carbaldehyde |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
178.099379689 u |
| Formula |
C11H14O2 |
| InChI |
InChI=1S/C11H14O2/c1-8-2-3-9-6-10(13)4-5-11(8,9)7-12/h6-8H,2-5H2,1H3/t8-,11-/m1/s1 |
| InChIKey |
DDINPEBRKSPKHY-LDYMZIIASA-N |
| Molecular Weight |
178.231 g/mol |
| SMILES |
C1=2[C@@](CCC(C2)=O)([C@](C)(CC1)[H])C=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.925217 |
