| SpectraBase Spectrum ID |
33PpNyCpaYE |
| Name |
1,2,3,4,5,6-hexa(trifluoroacetoxy)-hexadeutero-cyclohexane |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18D6F18O12 |
| InChI |
InChI=1S/C18H6F18O12/c19-13(20,21)7(37)43-1-2(44-8(38)14(22,23)24)4(46-10(40)16(28,29)30)6(48-12(42)18(34,35)36)5(47-11(41)17(31,32)33)3(1)45-9(39)15(25,26)27/h1-6H/i1D,2D,3D,4D,5D,6D |
| InChIKey |
KPMWXWRNPLWNBQ-MZWXYZOWSA-N |
| Molecular Weight |
762.242 g/mol |
| SMILES |
C1(C(C(OC(C(F)(F)F)=O)([2D])C(C(C1(OC(C(F)(F)F)=O)[2D])(OC(C(F)(F)F)=O)[2D])(OC(C(F)(F)F)=O)[2D])(OC(C(F)(F)F)=O)[2D])(OC(C(F)(F)F)=O)[2D] |
| SPLASH |
splash10-100r-0931200000-88546ddf4d426c097331 |
| Source of Spectrum |
KO-13-240-2 |
| Wiley ID |
1416434 |
