| SpectraBase Compound ID | DfLwyn66zkE |
|---|---|
| InChI | InChI=1S/C13H8INO/c14-10-6-7-11-12(8-10)16-15-13(11)9-4-2-1-3-5-9/h1-8H |
| InChIKey | CGMXAPHAKPNNAC-UHFFFAOYSA-N |
| Mol Weight | 321.12 g/mol |
| Molecular Formula | C13H8INO |
| Exact Mass | 320.965059 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7Rp6MODqMgP |
|---|---|
| Name | 6-Iodo-3-phenyl-1,2-benzisoxazole |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H8INO |
| InChI | InChI=1S/C13H8INO/c14-10-6-7-11-12(8-10)16-15-13(11)9-4-2-1-3-5-9/h1-8H |
| InChIKey | CGMXAPHAKPNNAC-UHFFFAOYSA-N |
| Molecular Weight | 321.117 g/mol |
| SMILES | c1(noc2cc(ccc12)I)-c1ccccc1 |
| SPLASH | splash10-00dj-0609000000-342f5d0bbe828994f7e0 |
| Source of Spectrum | OP-33-365-5 |
| Wiley ID | 1577878 |