| SpectraBase Spectrum ID |
8Y2oZWDZ2W5 |
| Name |
1-(1-Nitroethyl)-2-(perfluorophenyl)-1,2,3,4-tetrahydroisoquinoline |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
372.089718480 u |
| Formula |
C17H13F5N2O2 |
| InChI |
InChI=1S/C17H13F5N2O2/c1-8(24(25)26)16-10-5-3-2-4-9(10)6-7-23(16)17-14(21)12(19)11(18)13(20)15(17)22/h2-5,8,16H,6-7H2,1H3 |
| InChIKey |
FHDTVGCPVYXARN-UHFFFAOYSA-N |
| Instrument Name |
Agilent 5763 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201805137 |
| Molecular Weight |
372.295 g/mol |
| Quality |
25 |
| Reported Formula |
C17H13N2O2F5 |
| SMILES |
C1=CC2=C(C=C1)C(N(CC2)C1=C(C(=C(C(=C1F)F)F)F)F)C(C)[N+]([O-])=O |
| SPLASH |
splash10-0002-0190000000-38c97672a0e0ba1efdbd |
| Sample Comments |
dr = 71:29 |
| Source of Spectrum |
QE-24-SM14-5na (DOI: 10.1002/chem.201805137) |
| Thin-Layer Chromatography |
0.42 (hexane/EtOAc, 8:2) |
| Wiley ID |
1901915 |
