| SpectraBase Spectrum ID |
6oGigYBuYXu |
| Name |
2-Hydroxypropane-1,2,3-tricarboxylic acid, dimethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
220.058302719 u |
| Formula |
C8H12O7 |
| InChI |
InChI=1S/C8H12O7/c1-14-6(11)4-8(13,3-5(9)10)7(12)15-2/h13H,3-4H2,1-2H3,(H,9,10) |
| InChIKey |
OMIHCBSQSYMFDP-UHFFFAOYSA-N |
| Molecular Weight |
220.177 g/mol |
| SMILES |
C(C(CC(=O)O)(C(=O)OC)O)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.987376 |
