SpectraBase Spectrum ID |
HysgtmOUe8v |
Name |
Bisphenol, o,o'-bis(heptafluorobutyryl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
620.066853209 u |
Formula |
C23H14F14O4 |
InChI |
InChI=1S/C23H14F14O4/c1-17(2,11-3-7-13(8-4-11)40-15(38)18(24,25)20(28,29)22(32,33)34)12-5-9-14(10-6-12)41-16(39)19(26,27)21(30,31)23(35,36)37/h3-10H,1-2H3 |
InChIKey |
BGUNYYNBYXWHFV-UHFFFAOYSA-N |
Molecular Weight |
620.339 g/mol |
SMILES |
C1(=CC=C(C=C1)OC(=O)C(C(C(F)(F)F)(F)F)(F)F)C(C1=CC=C(C=C1)OC(=O)C(C(C(F)(F)F)(F)F)(F)F)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944283 |