| SpectraBase Compound ID | KtB8zC52fIl |
|---|---|
| InChI | InChI=1S/C18H13IO/c19-12-15(20)9-10-18-16-7-3-1-5-13(16)11-14-6-2-4-8-17(14)18/h1-11H,12H2/b10-9+ |
| InChIKey | BUZGUHGQTAIQLR-MDZDMXLPSA-N |
| Mol Weight | 372.21 g/mol |
| Molecular Formula | C18H13IO |
| Exact Mass | 372.00111 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Cv5UZv1RXTm |
|---|---|
| Name | (E)-1-Iodo-4-(9-anthryl)but-3-en-2-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 372.001110038 u |
| Formula | C18H13IO |
| InChI | InChI=1S/C18H13IO/c19-12-15(20)9-10-18-16-7-3-1-5-13(16)11-14-6-2-4-8-17(14)18/h1-11H,12H2/b10-9+ |
| InChIKey | BUZGUHGQTAIQLR-MDZDMXLPSA-N |
| Molecular Weight | 372.205 g/mol |
| SMILES | C1(\C=C\C(=O)CI)=C2C(C=CC=C2)=CC=2C1=CC=CC2 |