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N-[(p-acetamidophenyl)sulfonyl]glycine, cyanomethyl ester

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N-[(p-acetamidophenyl)sulfonyl]glycine, cyanomethyl ester
SpectraBase Compound ID 4rmW6YHTWTg
InChI InChI=1S/C12H13N3O5S/c1-9(16)15-10-2-4-11(5-3-10)21(18,19)14-8-12(17)20-7-6-13/h2-5,14H,7-8H2,1H3,(H,15,16)
InChIKey VYBPQJFLUPDSSQ-UHFFFAOYSA-N
Mol Weight 311.31 g/mol
Molecular Formula C12H13N3O5S
Exact Mass 311.057592 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CNdl7bqXKHp
Name N-[(p-acetamidophenyl)sulfonyl]glycine, cyanomethyl ester
Source of Sample S. Grudzinski, Academy of Medicine, Lodz, Poland
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Formula C12H13N3O5S
InChI InChI=1S/C12H13N3O5S/c1-9(16)15-10-2-4-11(5-3-10)21(18,19)14-8-12(17)20-7-6-13/h2-5,14H,7-8H2,1H3,(H,15,16)
InChIKey VYBPQJFLUPDSSQ-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 5921M
Solvent TFA
Synonyms ACETIC ACID, N4-ACETYLSULFANIL- AMIDO-, CYANOMETHYL ESTER GLYCINE, N-/P-ACETAMIDOPHENYL- SULFONYL/-, CYANOMETHYL ESTER