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(2S,3R)-3-(4-chlorophenyl)-2-hydroxy-3-(tosylamino)propionic acid methyl ester
SpectraBase Compound ID NN7XYgQ6mw
InChI InChI=1S/C17H18ClNO5S/c1-11-3-9-14(10-4-11)25(22,23)19-15(16(20)17(21)24-2)12-5-7-13(18)8-6-12/h3-10,15-16,19-20H,1-2H3/t15-,16+/m1/s1
InChIKey BLZNPUXUJZCEGJ-CVEARBPZSA-N
Mol Weight 383.85 g/mol
Molecular Formula C17H18ClNO5S
Exact Mass 383.059422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5IqSguwmWG
Name (2S,3R)-3-(4-chlorophenyl)-2-hydroxy-3-(tosylamino)propionic acid methyl ester
Alternate Name(s) (2S,3R)-3-(4-chlorophenyl)-2-hydroxy-3-[(4-methylphenyl)sulfonylamino]propanoic acid methyl ester Methyl (2S,3R)-3-(4-chlorophenyl)-2-hydroxy-3-(p-tolylsulfonylamino)propanoate Methyl (2S,3R)-3-(4-chlorophenyl)-3-[(4-methylphenyl)sulfonylamino]-2-oxidanyl-propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18ClNO5S
InChI InChI=1S/C17H18ClNO5S/c1-11-3-9-14(10-4-11)25(22,23)19-15(16(20)17(21)24-2)12-5-7-13(18)8-6-12/h3-10,15-16,19-20H,1-2H3/t15-,16+/m1/s1
InChIKey BLZNPUXUJZCEGJ-CVEARBPZSA-N
Molecular Weight 383.846 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)[C@@]([C@@](C(=O)OC)(O)[H])(c1ccc(cc1)Cl)[H]
SPLASH splash10-06r6-7590000000-e384df20bf16efb8cc9f
Source of Spectrum KC-61-6552-5
Wiley ID 1629684