| SpectraBase Spectrum ID |
EyIeFs0sKwK |
| Name |
(Endo)-1,2,2A,3,6,6A-hexahydro-3,6-methanobenzocyclobutene-1,2-dicarboxylic anhydride |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
190.062994179 u |
| Formula |
C11H10O3 |
| InChI |
InChI=1S/C11H10O3/c12-10-8-6-4-1-2-5(3-4)7(6)9(8)11(13)14-10/h1-2,4-9H,3H2 |
| InChIKey |
QXBXTTCGQJONDX-UHFFFAOYSA-N |
| Molecular Weight |
190.198 g/mol |
| SMILES |
C1(C2C(C(O1)=O)C1C2C2C=CC1C2)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.890605 |
