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3-Methyl-1-(phenylsulfonyl)-3-[3-N-(phenylsulfonyl)-N-(1-methoxycarbonylethyl)amino-2-methylenepropyl]-2,3-dihydro-1H-indole
SpectraBase Compound ID 3tjCFCrcYEk
InChI InChI=1S/C29H32N2O6S2/c1-22(20-30(23(2)28(32)37-4)38(33,34)24-13-7-5-8-14-24)19-29(3)21-31(27-18-12-11-17-26(27)29)39(35,36)25-15-9-6-10-16-25/h5-18,23H,1,19-21H2,2-4H3/t23-,29?/m0/s1
InChIKey SOMQLXYCUXZILT-QASNXKAYSA-N
Mol Weight 568.7 g/mol
Molecular Formula C29H32N2O6S2
Exact Mass 568.170179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4LJwiGRGwKM
Name 3-Methyl-1-(phenylsulfonyl)-3-[3-N-(phenylsulfonyl)-N-(1-methoxycarbonylethyl)amino-2-methylenepropyl]-2,3-dihydro-1H-indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H32N2O6S2
InChI InChI=1S/C29H32N2O6S2/c1-22(20-30(23(2)28(32)37-4)38(33,34)24-13-7-5-8-14-24)19-29(3)21-31(27-18-12-11-17-26(27)29)39(35,36)25-15-9-6-10-16-25/h5-18,23H,1,19-21H2,2-4H3/t23-,29?/m0/s1
InChIKey SOMQLXYCUXZILT-QASNXKAYSA-N
Molecular Weight 568.703 g/mol
SMILES c12N(S(=O)(=O)c3ccccc3)CC(c1cccc2)(CC(CN(S(=O)(=O)c1ccccc1)[C@](C(=O)OC)(C)[H])=C)C
SPLASH splash10-00di-3590000000-8a7d363c9a430c18f302
Source of Spectrum F-57-613-12
Wiley ID 1549318