| SpectraBase Spectrum ID |
6HvHEufP0aX |
| Name |
(1S,2R,6S)-2-Methyl-8-acetoxy-3-oxabicyclo[4.3.0]non-7(8-)-en-4-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
210.089208927 u |
| Formula |
C11H14O4 |
| InChI |
InChI=1S/C11H14O4/c1-6-10-5-9(15-7(2)12)3-8(10)4-11(13)14-6/h3,6,8,10H,4-5H2,1-2H3/t6-,8+,10-/m1/s1 |
| InChIKey |
JDONNQFRVBPJLX-KDILMLJESA-N |
| Molecular Weight |
210.229 g/mol |
| SMILES |
[C@@]12([C@@]([C@@](C)(OC(C2)=O)[H])(CC(=C1)OC(=O)C)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937359 |
![(1S,2R,6S)-2-Methyl-8-acetoxy-3-oxabicyclo[4.3.0]non-7(8-)-en-4-one](/api/spectrum/6HvHEufP0aX/structure.png?h=300&w=458 "(1S,2R,6S)-2-Methyl-8-acetoxy-3-oxabicyclo[4.3.0]non-7(8-)-en-4-one")
