SpectraBase Spectrum ID |
LMn3BvXhKY8 |
Name |
1H,3H-Furo[3,4-C]furan-1,6(4H)-dione, dihydro-6A-methyl-3-phenyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
232.073558862 u |
Formula |
C13H12O4 |
InChI |
InChI=1S/C13H12O4/c1-13-9(7-16-11(13)14)10(17-12(13)15)8-5-3-2-4-6-8/h2-6,9-10H,7H2,1H3 |
InChIKey |
HZFMPRYFFQEJQO-UHFFFAOYSA-N |
Molecular Weight |
232.235 g/mol |
SMILES |
C12(C(OC(C2COC1=O)C1=CC=CC=C1)=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919319 |