SpectraBase Spectrum ID |
1KJzyfAI2AL |
Name |
3-[fluoro(2,3,5,6-tetrafluorophenyl)methyl]azetidine oxalate salt |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H10F5NO4 |
InChI |
InChI=1S/C10H8F5N.C2H2O4/c11-5-1-6(12)10(15)7(9(5)14)8(13)4-2-16-3-4;3-1(4)2(5)6/h1,4,8,16H,2-3H2;(H,3,4)(H,5,6) |
InChIKey |
PXWDGWUDBHZGTE-UHFFFAOYSA-N |
Instrument Name |
HP 5970A |
Ionization Type |
EI |
Molecular Weight |
327.207 g/mol |
SMILES |
OC(C(=O)O)=O.N1CC(C1)C(c1c(c(cc(c1F)F)F)F)F |
SPLASH |
splash10-00kr-0920000000-85f2dc35796dfec36c94 |
Source of Spectrum |
WO2016185032A1 |
Wiley ID |
1855118 |