| SpectraBase Spectrum ID |
85TpuWBIcPf |
| Name |
Tetraethyl 1,2,3,4-tetrahydrophenanthrene-2,2,3,3-tetracarboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
470.194067918 u |
| Formula |
C26H30O8 |
| InChI |
InChI=1S/C26H30O8/c1-5-31-21(27)25(22(28)32-6-2)15-18-14-13-17-11-9-10-12-19(17)20(18)16-26(25,23(29)33-7-3)24(30)34-8-4/h9-14H,5-8,15-16H2,1-4H3 |
| InChIKey |
JOUWLYYUAGVSGE-UHFFFAOYSA-N |
| Molecular Weight |
470.518 g/mol |
| SMILES |
C1(C(CC2=C(C1)C1=C(C=C2)C=CC=C1)(C(=O)OCC)C(=O)OCC)(C(=O)OCC)C(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.957239 |
