| SpectraBase Spectrum ID |
A7P64XGot8D |
| Name |
2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-N-(2-methylbenzyl)-N-(2-(phenylethynyl)phenyl)octanamide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
693.114886648 u |
| Formula |
C30H18F15NO |
| InChI |
InChI=1S/C30H18F15NO/c1-18-9-5-6-13-21(18)17-46(22-14-8-7-12-20(22)16-15-19-10-3-2-4-11-19)23(47)24(31,32)25(33,34)26(35,36)27(37,38)28(39,40)29(41,42)30(43,44)45/h2-14H,17H2,1H3 |
| InChIKey |
OMFHQPMDZXRDRM-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202201132 |
| Molecular Weight |
693.456 g/mol |
| Quality |
1 |
| Reported Formula |
C30H18F15NO |
| SMILES |
C1=CC(=C(C=C1)N(CC1=C(C=CC=C1)C)C(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C#CC1=CC=CC=C1 |
| SPLASH |
splash10-0a4l-0820009000-aa96220c8c3eb49c46c5 |
| Source of Spectrum |
K1-26-SM46-15f (DOI: 10.1002/ejoc.202201132) |
| Thin-Layer Chromatography |
0.30 (cHex/EtOAc, 50:1) |
| Wiley ID |
1910476 |
