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Ethyl (2R,3R)-2-amino-3-(N-tosylamino)-3-(4-iodophenyl)propionate
SpectraBase Compound ID DBjdxQCkdwO
InChI InChI=1S/C18H21IN2O4S/c1-3-25-18(22)16(20)17(13-6-8-14(19)9-7-13)21-26(23,24)15-10-4-12(2)5-11-15/h4-11,16-17,21H,3,20H2,1-2H3/t16-,17-/m1/s1
InChIKey UXILCZRWYKILPX-IAGOWNOFSA-N
Mol Weight 488.34 g/mol
Molecular Formula C18H21IN2O4S
Exact Mass 488.026673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzijsrPeSvG
Name Ethyl (2R,3R)-2-amino-3-(N-tosylamino)-3-(4-iodophenyl)propionate
Alternate Name(s) Ethyl (2R,3R)-2-amino-3-(4-iodophenyl)-3-{[(4-methylphenyl)sulfonyl]amino}propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21IN2O4S
InChI InChI=1S/C18H21IN2O4S/c1-3-25-18(22)16(20)17(13-6-8-14(19)9-7-13)21-26(23,24)15-10-4-12(2)5-11-15/h4-11,16-17,21H,3,20H2,1-2H3/t16-,17-/m1/s1
InChIKey UXILCZRWYKILPX-IAGOWNOFSA-N
Molecular Weight 488.340 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)[C@@]([C@](C(=O)OCC)(N)[H])(c1ccc(cc1)I)[H]
SPLASH splash10-0006-9400000000-3b14b49d74f167f19e9c
Source of Spectrum QC-10-860-6
Wiley ID 871174