SpectraBase Spectrum ID |
7aEi35IgfSy |
Name |
Naphtho[1,2-C]furan-4,5-dicarboxylic acid, 1,3,4,5-tetrahydro-3-oxo-, dimethyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
302.079038165 u |
Formula |
C16H14O6 |
InChI |
InChI=1S/C16H14O6/c1-20-14(17)11-9-6-4-3-5-8(9)10-7-22-16(19)12(10)13(11)15(18)21-2/h3-6,11,13H,7H2,1-2H3 |
InChIKey |
ZTCLGKUMIGDYKB-UHFFFAOYSA-N |
Molecular Weight |
302.282 g/mol |
SMILES |
C(OC)(=O)C1C2=C(C=3C(C1C(OC)=O)=CC=CC3)COC2=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.977018 |