| SpectraBase Spectrum ID |
LMHAV2DFQ7z |
| Name |
2,3,5-triiodobenzoic acid |
| CAS Registry Number |
88-82-4 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
499.726714335 u |
| Formula |
C7H3I3O2 |
| InChI |
InChI=1S/C7H3I3O2/c8-3-1-4(7(11)12)6(10)5(9)2-3/h1-2H,(H,11,12) |
| InChIKey |
ZMZGFLUUZLELNE-UHFFFAOYSA-N |
| Molecular Weight |
499.812 g/mol |
| Nominal Mass |
500 u |
| Number of Peaks |
130 |
| SMILES |
OC(c1cc(cc(c1I)I)I)=O |
| SPLASH |
splash10-0uk9-9182570000-54c13f05f908a97b039e |
| Source of Spectrum |
Dr. Rolf Kuehnle |
| Synonyms |
TIBA |
| Technique |
GC/MS |
| Wiley ID |
WID_MSPA_4275 |
