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2-Hydroxy-5-phenyl-3-(tosylamino)pentanoic acid
SpectraBase Compound ID 5sOOs07XVwV
InChI InChI=1S/C18H21NO5S/c1-13-7-10-15(11-8-13)25(23,24)19-16(17(20)18(21)22)12-9-14-5-3-2-4-6-14/h2-8,10-11,16-17,19-20H,9,12H2,1H3,(H,21,22)
InChIKey AGBQJWOZJRQQLY-UHFFFAOYSA-N
Mol Weight 363.43 g/mol
Molecular Formula C18H21NO5S
Exact Mass 363.114044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AuUn4rUuNDE
Name 2-Hydroxy-5-phenyl-3-(tosylamino)pentanoic acid
Alternate Name(s) 3,4,5-trideoxy-3-{[(4-methylphenyl)sulfonyl]amino}-5-phenylpentonic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO5S
InChI InChI=1S/C18H21NO5S/c1-13-7-10-15(11-8-13)25(23,24)19-16(17(20)18(21)22)12-9-14-5-3-2-4-6-14/h2-8,10-11,16-17,19-20H,9,12H2,1H3,(H,21,22)
InChIKey AGBQJWOZJRQQLY-UHFFFAOYSA-N
Molecular Weight 363.428 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C(C(C(=O)O)O)CCc1ccccc1
SPLASH splash10-052u-6190000000-251619d97699ad70e5b2
Source of Spectrum H-79-1214-23
Wiley ID 1350182