SpectraBase Spectrum ID |
1tqaF1Q62dL |
Name |
Bisphenol A propoxylate (3.6 po/phenol), average mn ~645 |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
304.167459249 u |
Formula |
C18H24O4 |
InChI |
InChI=1S/C15H16O2.C3H8O2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;4-2-1-3-5/h3-10,16-17H,1-2H3;4-5H,1-3H2 |
InChIKey |
MEBNBMJYONDXTB-UHFFFAOYSA-N |
Molecular Weight |
304.386 g/mol |
SMILES |
C(CO)CO.C(C1=CC=C(O)C=C1)(C1=CC=C(C=C1)O)(C)C |
Spectrum/Structure Validation Score (Raman) |
0.991345 |