| SpectraBase Spectrum ID |
3GG0f6WXQ4M |
| Name |
(1S)-1-Methylbicyclo[4.3.0]nona-5(6)-ene-9-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
150.104465070 u |
| Formula |
C10H14O |
| InChI |
InChI=1S/C10H14O/c1-10-7-3-2-4-8(10)5-6-9(10)11/h4H,2-3,5-7H2,1H3/t10-/m0/s1 |
| InChIKey |
XESVANBZXRHMRY-JTQLQIEISA-N |
| Molecular Weight |
150.221 g/mol |
| SMILES |
[C@]12(C(CCC2=O)=CCCC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.986607 |
![(1S)-1-Methylbicyclo[4.3.0]nona-5(6)-ene-9-one](/api/spectrum/3GG0f6WXQ4M/structure.png?h=300&w=458 "(1S)-1-Methylbicyclo[4.3.0]nona-5(6)-ene-9-one")
