| SpectraBase Compound ID | KBADwgCYeRx |
|---|---|
| InChI | InChI=1S/C12H9IO4/c1-6-5-10(15)17-12-8(6)3-4-9(11(12)13)16-7(2)14/h3-5H,1-2H3 |
| InChIKey | YFOCOVBSNQHYKD-UHFFFAOYSA-N |
| Mol Weight | 344.1 g/mol |
| Molecular Formula | C12H9IO4 |
| Exact Mass | 343.954554 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | CvdcSdzurYS |
|---|---|
| Name | 7-HYDROXY-8-IODO-4-METHYLCOUMARIN, ACETATE |
| Source of Sample | A. Cascaval, Polytechnic Institute of Iassy, Iasi, Romania |
| Copyright | Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H9IO4 |
| InChI | InChI=1S/C12H9IO4/c1-6-5-10(15)17-12-8(6)3-4-9(11(12)13)16-7(2)14/h3-5H,1-2H3 |
| InChIKey | YFOCOVBSNQHYKD-UHFFFAOYSA-N |
| Instrument Name | BRUKER AC-300 |
| Melting Point | 179-180C |
| Molecular Weight | 344.11 |
| Solvent | CDCl3; Reference=TMS; Temperature 297K |