| SpectraBase Compound ID | Y1BbKSqRZ7 |
|---|---|
| InChI | InChI=1S/C21H22N2O5S.Na/c1-4-28-13-10-9-11-7-5-6-8-12(11)14(13)17(24)22-15-18(25)23-16(20(26)27)21(2,3)29-19(15)23;/h5-10,15-16,19H,4H2,1-3H3,(H,22,24)(H,26,27);/q;+1/p-1/t15-,16+,19-;/m0./s1 |
| InChIKey | AYAPZOUDXCDGIF-YONMQPCQSA-M |
| Mol Weight | 436.46 g/mol |
| Molecular Formula | C21H21N2NaO5S |
| Exact Mass | 436.106887 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5YbSTm4NutU |
|---|---|
| Name | NA-NAFCILLIN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H21N2NaO5S |
| InChI | InChI=1S/C21H22N2O5S.Na/c1-4-28-13-10-9-11-7-5-6-8-12(11)14(13)17(24)22-15-18(25)23-16(20(26)27)21(2,3)29-19(15)23;/h5-10,15-16,19H,4H2,1-3H3,(H,22,24)(H,26,27);/q;+1/p-1/t15-,16+,19-;/m0./s1 |
| InChIKey | AYAPZOUDXCDGIF-YONMQPCQSA-M |
| 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 | 436.458 g/mol |
| Solvent | D2O |
| Source File Reference | UNIW22349 |