Chlortetracycline
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA001821
Dataset description:
This MassBank record with Accession MSBNK-Waters-WA001821 contains the MS mass spectrum of Chlortetracycline with the InChIkey CYDMQBQPVICBEU-XRNKAMNCSA-N.
Source: Chlortetracycline
Chemical Info
| InChI | InChI=1S/C22H23ClN2O8/c1-21(32)7-6-8-15(25(2)3)17(28)13(20(24)31)19(30)22(8,33)18(29)11(7)16(27)12-10(26)5-4-9(23)14(12)21/h4-5,7-8,15,26,28-29,32-33H,6H2,1-3H3,(H2,24,31)/t7-,8-,15-,21-,22-/m0/s1 |
|---|---|
| SMILES | NC(=O)C(=C(O)4)C(=O)C(O)(C(O)=1)C([H])(C(N(C)C)4)CC([H])(C(C)(O)2)C(C(=O)c(c(O)3)c(c(Cl)cc3)2)1 |
| InChI Key | CYDMQBQPVICBEU-XRNKAMNCSA-N |
| Molecular Formula | C22H23ClN2O8 |
| Exact Mass | 478.114 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | January 11, 2024 |
| Metadata last updated | January 11, 2024 |
| Created | January 11, 2024 |
| Format | HTML |
| License | Attribution-NonCommercial 4.0 International (CC BY-NC 4.0) |
| Id | a186745c-5d00-4e7d-848a-48f579137fc3 |
| Package id | msbnk-waters-wa001821 |
| Resource type | HTML |
| State | active |