| SpectraBase Spectrum ID |
AkVINbYwp7A |
| Name |
2-(3,4-Dibromo-5-oxo-2,5-dihydro-furan-2-yl)-indan-1,3-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
383.863284669 u |
| Formula |
C13H6Br2O4 |
| InChI |
InChI=1S/C13H6Br2O4/c14-8-9(15)13(18)19-12(8)7-10(16)5-3-1-2-4-6(5)11(7)17/h1-4,7,12H |
| InChIKey |
PKAQMEAEZWMKTP-UHFFFAOYSA-N |
| Molecular Weight |
385.995 g/mol |
| SMILES |
C1(C2C(=C(Br)C(O2)=O)Br)C(C2=CC=CC=C2C1=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921142 |
