SpectraBase Compound ID | KRT8icjqrTf |
---|---|
InChI | InChI=1S/C8H12O/c1-2-4-6-8-7(9-8)5-3-1/h1-2,7-8H,3-6H2/b2-1- |
InChIKey | YWFPXWMSGJXUFS-UPHRSURJSA-N |
Mol Weight | 124.18 g/mol |
Molecular Formula | C8H12O |
Exact Mass | 124.088815 g/mol |
SpectraBase Spectrum ID | GyHs0srtXns |
---|---|
Name | 9-Oxabicyclo[6.1.0]non-4-ene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 124.088815005 u |
Formula | C8H12O |
InChI | InChI=1S/C8H12O/c1-2-4-6-8-7(9-8)5-3-1/h1-2,7-8H,3-6H2/b2-1- |
InChIKey | YWFPXWMSGJXUFS-UPHRSURJSA-N |
Molecular Weight | 124.183 g/mol |
SMILES | C1CC2OC2CC\C=C/1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.928523 |