SpectraBase Spectrum ID |
89XfAL5fkHU |
Name |
1-Ethyl-3-(iodomethyl)-4-(2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptyl)cyclopentanecarboxylic acid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H16F13IO2 |
InChI |
InChI=1S/C16H16F13IO2/c1-2-10(9(31)32)3-7(8(4-10)6-30)5-11(17,18)12(19,20)13(21,22)14(23,24)15(25,26)16(27,28)29/h7-8H,2-6H2,1H3,(H,31,32)/t7-,8+,10+/m0/s1 |
InChIKey |
BXLKMAQTHWDPRM-QXFUBDJGSA-N |
Molecular Weight |
614.186 g/mol |
SMILES |
OC([C@@]1(C[C@@](CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)([C@](C1)(CI)[H])[H])CC)=O |
SPLASH |
splash10-0007-0003900000-813b8d2ac44b460f2e11 |
Source of Spectrum |
F-66-7293-4ba |
Wiley ID |
1681134 |