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[6-(hydroxymethyl)-2-pyridyl]methyl (2S)-3-phenyl-2-(p-tolylsulfonylamino)propanoate
SpectraBase Compound ID 3FkRhRgIaWN
InChI InChI=1S/C23H24N2O5S/c1-17-10-12-21(13-11-17)31(28,29)25-22(14-18-6-3-2-4-7-18)23(27)30-16-20-9-5-8-19(15-26)24-20/h2-13,22,25-26H,14-16H2,1H3/t22-/m0/s1
InChIKey YKZSPVFIQYNYAC-QFIPXVFZSA-N
Mol Weight 440.51 g/mol
Molecular Formula C23H24N2O5S
Exact Mass 440.140593 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kzk2FAn35pP
Name [6-(hydroxymethyl)-2-pyridyl]methyl (2S)-3-phenyl-2-(p-tolylsulfonylamino)propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H24N2O5S
InChI InChI=1S/C23H24N2O5S/c1-17-10-12-21(13-11-17)31(28,29)25-22(14-18-6-3-2-4-7-18)23(27)30-16-20-9-5-8-19(15-26)24-20/h2-13,22,25-26H,14-16H2,1H3/t22-/m0/s1
InChIKey YKZSPVFIQYNYAC-QFIPXVFZSA-N
Instrument Name VG-ZAB-HS
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19980831)12_16_1057
Molecular Weight 440.514 g/mol
SMILES OCc1cccc(COC([C@](Cc2ccccc2)(NS(c2ccc(cc2)C)(=O)=O)[H])=O)n1
SPLASH splash10-0006-9000000000-175c2e0750705e1ef362
Source of Spectrum RCM-12-1059-9
Wiley ID 1838866