| SpectraBase Compound ID | AwB4SFmPgp6 |
|---|---|
| InChI | InChI=1S/C14H17N5O5S2/c1-14(2)8(12(22)23)19-10(21)7(11(19)26-14)17-9(20)6(18-24-3)5-4-25-13(15)16-5/h4,7-8,11H,1-3H3,(H2,15,16)(H,17,20)(H,22,23)/b18-6+/t7-,8+,11-/m0/s1 |
| InChIKey | HJMOOTIZOZYPPH-IELPTQQQSA-N |
| Mol Weight | 399.44 g/mol |
| Molecular Formula | C14H17N5O5S2 |
| Exact Mass | 399.067111 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8zFB7PWUkxW |
|---|---|
| Name | AMINOTHIAZOLYL-PENICILLINE |
| Compound Number | 2234 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C14H17N5O5S2 |
| InChI | InChI=1S/C14H17N5O5S2/c1-14(2)8(12(22)23)19-10(21)7(11(19)26-14)17-9(20)6(18-24-3)5-4-25-13(15)16-5/h4,7-8,11H,1-3H3,(H2,15,16)(H,17,20)(H,22,23)/b18-6+/t7-,8+,11-/m0/s1 |
| InChIKey | HJMOOTIZOZYPPH-IELPTQQQSA-N |
| Literature Reference Author | W.ROBIEN |
| Literature Reference Citation | W.ROBIEN,PRIVATE_COMMUNICATION |
| Molecular Weight | 399.439 g/mol |
| Sample ID | 525 |
| Solvent | DMSO-D6 |