| SpectraBase Spectrum ID |
LnLzonV6Rvg |
| Name |
2,5-di-Tert-butylhydroquinone, o,o'-bis(heptafluorobutyryl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
614.113803402 u |
| Formula |
C22H20F14O4 |
| InChI |
InChI=1S/C22H20F14O4/c1-15(2,3)9-7-12(40-14(38)18(25,26)20(29,30)22(34,35)36)10(16(4,5)6)8-11(9)39-13(37)17(23,24)19(27,28)21(31,32)33/h7-8H,1-6H3 |
| InChIKey |
NTGQEMSBVPLVKJ-UHFFFAOYSA-N |
| Molecular Weight |
614.376 g/mol |
| SMILES |
C(C)(C)(C)C1=C(OC(=O)C(C(C(F)(F)F)(F)F)(F)F)C=C(C(=C1)OC(=O)C(C(C(F)(F)F)(F)F)(F)F)C(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.850467 |
