| SpectraBase Spectrum ID |
5tRvNP2sPuh |
| Name |
(1S,6S)-6-Methyl-7-oxobicyclo[4.3.0]nonane-8-carboxaldehyde |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
180.115029753 u |
| Formula |
C11H16O2 |
| InChI |
InChI=1S/C11H16O2/c1-11-5-3-2-4-9(11)6-8(7-12)10(11)13/h7-9H,2-6H2,1H3/t8?,9-,11-/m0/s1 |
| InChIKey |
HFANPRVGZSLHOW-PCFYAGROSA-N |
| Molecular Weight |
180.247 g/mol |
| SMILES |
[C@@]12(C(C(C=O)C[C@@]2(CCCC1)[H])=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.885738 |
![(1S,6S)-6-Methyl-7-oxobicyclo[4.3.0]nonane-8-carboxaldehyde](/api/spectrum/5tRvNP2sPuh/structure.png?h=300&w=458 "(1S,6S)-6-Methyl-7-oxobicyclo[4.3.0]nonane-8-carboxaldehyde")
