| SpectraBase Spectrum ID |
GGTEh1TGKQW |
| Name |
Terephthalic acid, di(2-ethoxyethyl) ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
310.141638422 u |
| Formula |
C16H22O6 |
| InChI |
InChI=1S/C16H22O6/c1-3-19-9-11-21-15(17)13-5-7-14(8-6-13)16(18)22-12-10-20-4-2/h5-8H,3-4,9-12H2,1-2H3 |
| InChIKey |
PTINJMSTTLBEHT-UHFFFAOYSA-N |
| Molecular Weight |
310.346 g/mol |
| SMILES |
C(OC(=O)C1=CC=C(C=C1)C(=O)OCCOCC)COCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955842 |
