| SpectraBase Compound ID | XoW4TDo6XS |
|---|---|
| InChI | InChI=1S/C20H21N3O5S/c1-10-12(13(22-28-10)11-8-6-5-7-9-11)16(24)21-14-17(25)23-15(19(26)27-4)20(2,3)29-18(14)23/h5-9,14-15,18H,1-4H3,(H,21,24) |
| InChIKey | OUIFFUJXNMDTRR-UHFFFAOYSA-N |
| Mol Weight | 415.46 g/mol |
| Molecular Formula | C20H21N3O5S |
| Exact Mass | 415.120192 g/mol |
15N Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4OvzMbNe0MN |
|---|---|
| Name | Oxacillin methyl ester |
| Comments | CH2CL2/C6D6 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C20H21N3O5S |
| InChI | InChI=1S/C20H21N3O5S/c1-10-12(13(22-28-10)11-8-6-5-7-9-11)16(24)21-14-17(25)23-15(19(26)27-4)20(2,3)29-18(14)23/h5-9,14-15,18H,1-4H3,(H,21,24) |
| InChIKey | OUIFFUJXNMDTRR-UHFFFAOYSA-N |
| Instrument Name | Jeol PFT-100 |
| Literature Reference | J.W. Paschal et. al., J. Org. Chem. 43, 2013 (1978). |
| NMR Standard | CH3NO2 |
| Observed nucleus | 15N |