| SpectraBase Spectrum ID |
3jeZ7v13076 |
| Name |
6-Endo-phenyl-4-methyl-3-oxabicyclo[3.1.0]hexen-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
188.083729624 u |
| Formula |
C12H12O2 |
| InChI |
InChI=1S/C12H12O2/c1-7-9-10(11(9)12(13)14-7)8-5-3-2-4-6-8/h2-7,9-11H,1H3/t7-,9-,10?,11-/m1/s1 |
| InChIKey |
BCIKHCCKMGGFPS-SHTJTBLVSA-N |
| Molecular Weight |
188.226 g/mol |
| SMILES |
C1([C@]2([H])C(O[C@](C)([C@]12[H])[H])=O)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.882164 |
![6-Endo-phenyl-4-methyl-3-oxabicyclo[3.1.0]hexen-2-one](/api/spectrum/3jeZ7v13076/structure.png?h=300&w=458 "6-Endo-phenyl-4-methyl-3-oxabicyclo[3.1.0]hexen-2-one")
