![(2R,7R)-3-methyl-8-oxo-7-(2-phenoxyacetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, diphenylmethyl ester, 5,5-dioxide](/api/spectrum/GC1B4VGVgRb/structure.png?h=300&w=458 "(2R,7R)-3-methyl-8-oxo-7-(2-phenoxyacetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, diphenylmethyl ester, 5,5-dioxide")
| SpectraBase Compound ID | ejGNgW1C01 |
|---|---|
| InChI | InChI=1S/C29H26N2O7S/c1-19-18-39(35,36)28-24(30-23(32)17-37-22-15-9-4-10-16-22)27(33)31(28)25(19)29(34)38-26(20-11-5-2-6-12-20)21-13-7-3-8-14-21/h2-16,24,26,28H,17-18H2,1H3,(H,30,32)/t24-,28-/m1/s1 |
| InChIKey | XAUKNPUNZCGQQM-UFHPHHKVSA-N |
| Mol Weight | 546.59 g/mol |
| Molecular Formula | C29H26N2O7S |
| Exact Mass | 546.146072 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GC1B4VGVgRb |
|---|---|
| Name | (2R,7R)-3-methyl-8-oxo-7-(2-phenoxyacetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, diphenylmethyl ester, 5,5-dioxide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H26N2O7S |
| InChI | InChI=1S/C29H26N2O7S/c1-19-18-39(35,36)28-24(30-23(32)17-37-22-15-9-4-10-16-22)27(33)31(28)25(19)29(34)38-26(20-11-5-2-6-12-20)21-13-7-3-8-14-21/h2-16,24,26,28H,17-18H2,1H3,(H,30,32)/t24-,28-/m1/s1 |
| InChIKey | XAUKNPUNZCGQQM-UFHPHHKVSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 49376M |
| Solvent | CDCl3 |