| SpectraBase Spectrum ID |
CNYfyhuJvpp |
| Name |
[4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-Henicosafluorododecyl)phenyl]methyl (E)-hex-2-enoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
750.104971273 u |
| Formula |
C25H19F21O2 |
| InChI |
InChI=1S/C25H19F21O2/c1-2-3-4-5-15(47)48-12-14-8-6-13(7-9-14)10-11-16(26,27)17(28,29)18(30,31)19(32,33)20(34,35)21(36,37)22(38,39)23(40,41)24(42,43)25(44,45)46/h4-9H,2-3,10-12H2,1H3/b5-4+ |
| InChIKey |
KVMARRJODPVANJ-SNAWJCMRSA-N |
| Molecular Weight |
750.391 g/mol |
| SMILES |
C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(CCC1=CC=C(C=C1)COC(\C=C\CCC)=O)(F)F)(F)F)(F)F)(F)F)(F)F |
![[4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecyl)phenyl]methyl (E)-hex-2-enoate](/api/spectrum/CNYfyhuJvpp/structure.png?h=300&w=458 "[4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecyl)phenyl]methyl (E)-hex-2-enoate")
