| SpectraBase Compound ID | 2HTuzxO3x5c |
|---|---|
| InChI | InChI=1S/C7H3I3O2/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2H,(H,11,12) |
| InChIKey | UCBKDZNMPMBJAB-UHFFFAOYSA-N |
| Mol Weight | 499.81 g/mol |
| Molecular Formula | C7H3I3O2 |
| Exact Mass | 499.726714 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IjheQvEUOpd |
|---|---|
| Name | 3,4,5-Trijodobenzoesaeure |
| CAS Registry Number | 2338-20-7 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H3I3O2 |
| InChI | InChI=1S/C7H3I3O2/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2H,(H,11,12) |
| InChIKey | UCBKDZNMPMBJAB-UHFFFAOYSA-N |
| Literature Reference | J. Org. Chem. 49, 3051 (1984). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | DMSO-D6 |