| SpectraBase Spectrum ID |
2ZEKk8rXE0 |
| Name |
2,3,4,5,6-Pentadeuteriobenzoic acid |
| Alternate Name(s) |
Benzoic acid, 2,3,4,5,6-pentadeutero- |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7HD5O2 |
| InChI |
InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)/i1D,2D,3D,4D,5D |
| InChIKey |
WPYMKLBDIGXBTP-RALIUCGRSA-N |
| Molecular Weight |
127.154 g/mol |
| SMILES |
OC(=O)c1c(c([D])c(c(c1[D])[D])[D])[D] |
| SPLASH |
splash10-0h0r-7900000000-844de399814a2305ba60 |
| Source of Spectrum |
UE-15-0-0 |
| Wiley ID |
1127836 |
