| SpectraBase Spectrum ID |
3wttSLtZFVo |
| Name |
Dimethyl 2,4-bis(4-hydroxyphenyl)cyclobutane-1,3-dicarboxylate, diacetate (isomer 2) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
440.147117725 u |
| Formula |
C24H24O8 |
| InChI |
InChI=1S/C24H24O8/c1-13(25)31-17-9-5-15(6-10-17)19-21(23(27)29-3)20(22(19)24(28)30-4)16-7-11-18(12-8-16)32-14(2)26/h5-12,19-22H,1-4H3 |
| InChIKey |
VPAZRXRUJXETGK-UHFFFAOYSA-N |
| Molecular Weight |
440.448 g/mol |
| SMILES |
C1(C(C(C1C1=CC=C(C=C1)OC(=O)C)C(=O)OC)C1=CC=C(C=C1)OC(=O)C)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962829 |
