| SpectraBase Compound ID | 8Pfyz71kjj9 |
|---|---|
| InChI | InChI=1S/C16H21N3O4S/c1-16(2)11(15(22)23)19-13(21)10(14(19)24-16)18-12(20)9(17)8-6-4-3-5-7-8/h3-4,7,9-11,14H,5-6,17H2,1-2H3,(H,18,20)(H,22,23)/t9?,10-,11+,14-/m1/s1 |
| InChIKey | RPBAFSBGYDKNRG-UWFZAAFLSA-N |
| Mol Weight | 351.42 g/mol |
| Molecular Formula | C16H21N3O4S |
| Exact Mass | 351.125277 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9RVJx6KuuPz |
|---|---|
| Name | EPICILLIN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C16H21N3O4S |
| InChI | InChI=1S/C16H21N3O4S/c1-16(2)11(15(22)23)19-13(21)10(14(19)24-16)18-12(20)9(17)8-6-4-3-5-7-8/h3-4,7,9-11,14H,5-6,17H2,1-2H3,(H,18,20)(H,22,23)/t9?,10-,11+,14-/m1/s1 |
| InChIKey | RPBAFSBGYDKNRG-UWFZAAFLSA-N |
| Literature Reference Author | S.K.BRANCH,A.F.CASY,A.LIPCZYNSKI,E.M.A.OMINDE |
| Literature Reference Citation | MAGN.RES.CHEM.,24,465(1986) |
| Literature Reference DOI | 10.1002/mrc.1260240602 |
| Molecular Weight | 351.420 g/mol |
| Solvent | CF3COOH |
| Source File Reference | UNIW22359 |