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(2S)-2-[2-cyclopropylideneethyl(tosyl)amino]-3-(1H-indol-3-yl)propionic acid methyl ester
SpectraBase Compound ID 4sRensHruRS
InChI InChI=1S/C24H26N2O4S/c1-17-7-11-20(12-8-17)31(28,29)26(14-13-18-9-10-18)23(24(27)30-2)15-19-16-25-22-6-4-3-5-21(19)22/h3-8,11-13,16,23,25H,9-10,14-15H2,1-2H3/t23-/m0/s1
InChIKey XOZZKDYUSDZCKZ-QHCPKHFHSA-N
Mol Weight 438.54 g/mol
Molecular Formula C24H26N2O4S
Exact Mass 438.161328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CbzaMo5zsAD
Name (2S)-2-[2-cyclopropylideneethyl(tosyl)amino]-3-(1H-indol-3-yl)propionic acid methyl ester
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Formula C24H26N2O4S
InChI InChI=1S/C24H26N2O4S/c1-17-7-11-20(12-8-17)31(28,29)26(14-13-18-9-10-18)23(24(27)30-2)15-19-16-25-22-6-4-3-5-21(19)22/h3-8,11-13,16,23,25H,9-10,14-15H2,1-2H3/t23-/m0/s1
InChIKey XOZZKDYUSDZCKZ-QHCPKHFHSA-N
Molecular Weight 438.542 g/mol
SMILES [nH]1c2c(c(c1)C[C@@](C(=O)OC)(N(S(=O)(=O)c1ccc(C)cc1)CC=C1CC1)[H])cccc2
SPLASH splash10-001i-5910000000-efc19d8c61096976fdbd
Source of Spectrum U1-1999-2731-25
Synonyms (2S)-2-[2-cyclopropylideneethyl-(4-methylphenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoic acid methyl ester Methyl (2S)-2-[2-cyclopropylideneethyl(p-tolylsulfonyl)amino]-3-(1H-indol-3-yl)propanoate Methyl (2S)-2-[2-cyclopropylideneethyl-(4-methylphenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate
Wiley ID 753235