| SpectraBase Spectrum ID |
8OTNhBiGBOX |
| Name |
Diethyl 5,6-bis(hydroxymethyl)indane-2,2-dicarboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.141638422 u |
| Formula |
C17H22O6 |
| InChI |
InChI=1S/C17H22O6/c1-3-22-15(20)17(16(21)23-4-2)7-11-5-13(9-18)14(10-19)6-12(11)8-17/h5-6,18-19H,3-4,7-10H2,1-2H3 |
| InChIKey |
UYOWAJIKHCHVIV-UHFFFAOYSA-N |
| Molecular Weight |
322.357 g/mol |
| SMILES |
C1(CC=2C=C(CO)C(=CC2C1)CO)(C(=O)OCC)C(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.839676 |
