SpectraBase Spectrum ID |
BNdqV3Eqjtu |
Name |
Acetic acid, trifluoro-, 4-[2-[(trifluoroacetyl)amino]ethyl-1,1,2,2-D4]-1,2-phenylene ester |
CAS Registry Number |
53833-21-9 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H4D4F9NO5 |
InChI |
InChI=1S/C14H8F9NO5/c15-12(16,17)9(25)24-4-3-6-1-2-7(28-10(26)13(18,19)20)8(5-6)29-11(27)14(21,22)23/h1-2,5H,3-4H2,(H,24,25)/i3D2,4D2 |
InChIKey |
ROWYZKLUWDEHTH-KHORGVISSA-N |
Molecular Weight |
445.230 g/mol |
SMILES |
N(C(C(F)(F)F)=O)C(C(c1ccc(c(OC(C(F)(F)F)=O)c1)OC(C(F)(F)F)=O)([2D])[2D])([2D])[2D] |
SPLASH |
splash10-001i-1009000000-0a29440c6409ed4e4f74 |
Source of Spectrum |
JC-99-533-3 |
Synonyms |
Deuterodopamine-trifluoroacetyl |
Wiley ID |
1384993 |