| SpectraBase Spectrum ID |
E9NLMvQQQox |
| Name |
2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Pentadecafluoro-N,N'-bis(4-methoxyphenyl)caprylamidine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
624.089400174 u |
| Formula |
C22H15F15N2O2 |
| InChI |
InChI=1S/C22H15F15N2O2/c1-40-13-7-3-11(4-8-13)38-15(39-12-5-9-14(41-2)10-6-12)16(23,24)17(25,26)18(27,28)19(29,30)20(31,32)21(33,34)22(35,36)37/h3-10H,1-2H3,(H,38,39) |
| InChIKey |
LNPZHMHLQQTGHV-UHFFFAOYSA-N |
| Molecular Weight |
624.350 g/mol |
| SMILES |
C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(C(\C(=N\C=1C=CC(=CC1)OC)NC=1C=CC(=CC1)OC)(F)F)(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.833338 |
