atmospheric pressure chemical ionisation mass...
URL: https://www.chemotion-repository.net/inchikey/AWMSQAWTIORNKD-CHBPNCHNSA-N/CHMO0000473
Dataset description:
dataset for atmospheric pressure chemical ionisation mass spectrometry (APCI MS)\n\n
Source: atmospheric pressure chemical ionisation mass spectrometry (APCI MS)
Chemical Info
| InChI | InChI=1S/C26H23FN2O4/c1-14-23(28-24(30)15-8-10-16(27)11-9-15)22-20(12-17(32-2)13-21(22)33-3)26(14)19-7-5-4-6-18(19)25(31)29-26/h4-14,23H,1-3H3,(H,28,30)(H,29,31)/t14-,23-,26+/m1/s1 |
|---|---|
| SMILES | COc1cc(OC)c2c(c1)[C@]1(NC(=O)c3c1cccc3)[C@@H]([C@H]2NC(=O)c1ccc(cc1)F)C |
| InChI Key | AWMSQAWTIORNKD-CHBPNCHNSA-N |
| Molecular Formula | C26H23FN2O4 |
| Exact Mass | 446.470 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | September 8, 2024 |
| Metadata last updated | September 8, 2024 |
| Created | September 8, 2024 |
| Format | HTML |
| License | No License Provided |
| Id | abc6030a-b67a-4e24-993a-2b52db326ad4 |
| Package id | 10-14272-awmsqawtiornkd-chbpnchnsa-n-chmo0000473 |
| Resource type | HTML |
| State | active |