SpectraBase Spectrum ID |
7wt1G24fZ2W |
Name |
4-oxo-4-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]butanoic acid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C11H5D7O3 |
InChI |
InChI=1S/C11H12O3/c1-8-2-4-9(5-3-8)10(12)6-7-11(13)14/h2-5H,6-7H2,1H3,(H,13,14)/i1D3,2D,3D,4D,5D |
InChIKey |
OEEUWZITKKSXAZ-AAYPNNLASA-N |
Ionization Type |
EI |
Molecular Weight |
199.257 g/mol |
Reported Formula |
C11H5D7O3 |
SMILES |
OC(CCC(c1c(c(c(C([D])([D])[D])c(c1[D])[D])[D])[D])=O)=O |
SPLASH |
splash10-004i-2900000000-287429e68cbae0bcbe42 |
Source of Spectrum |
CN102234275B |
Wiley ID |
1850217 |