1H nuclear magnetic resonance spectroscopy (1H NMR)
URL: https://www.chemotion-repository.net/inchikey/XQBNRFKTLBHETJ-FDDCHVKYSA-N/CHMO0000593
Dataset description:
dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n
Chemical Info
| InChI | InChI=1S/C23H19BrO4/c1-13-9-10-23(22(27)17-12-14(28-2)7-8-19(17)24)18(11-13)20(25)15-5-3-4-6-16(15)21(23)26/h3-9,12,18H,10-11H2,1-2H3/t18-,23+/m0/s1 |
|---|---|
| SMILES | COc1ccc(c(c1)C(=O)[C@]12CC=C(C[C@H]1C(=O)c1c(C2=O)cccc1)C)Br |
| InChI Key | XQBNRFKTLBHETJ-FDDCHVKYSA-N |
| Molecular Formula | C23H19BrO4 |
| Exact Mass | 439.299 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | September 7, 2024 |
| Metadata last updated | September 7, 2024 |
| Created | September 7, 2024 |
| Format | HTML |
| License | No License Provided |
| Id | faa46817-b6e5-4b19-9a9a-a4736593f50c |
| Package id | 10-14272-xqbnrfktlbhetj-fddchvkysa-n-chmo0000593 |
| Resource type | HTML |
| State | active |