SpectraBase Spectrum ID |
3oGmCHAogHS |
Name |
1H-Cyclopropa[B]naphthalene-2,7-dione/furan exo adduct |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
238.062994179 u |
Formula |
C15H10O3 |
InChI |
InChI=1S/C15H10O3/c16-12-8-3-1-2-4-9(8)13(17)15-7-14(12,15)10-5-6-11(15)18-10/h1-6,10-11H,7H2 |
InChIKey |
XUOWWCGEZQZDAI-UHFFFAOYSA-N |
Molecular Weight |
238.242 g/mol |
SMILES |
C123C(C(=O)C=4C(C3=O)=CC=CC4)(C3OC2C=C3)C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.929628 |