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2-mesityl-N-methyl-1-oxo-N-tosyl-1H-indene-3-carboxamide
SpectraBase Compound ID 7Uzf408pnWj
InChI InChI=1S/C27H25NO4S/c1-16-10-12-20(13-11-16)33(31,32)28(5)27(30)24-21-8-6-7-9-22(21)26(29)25(24)23-18(3)14-17(2)15-19(23)4/h6-15H,1-5H3
InChIKey RCPJIWHMYKAZLD-UHFFFAOYSA-N
Mol Weight 459.56 g/mol
Molecular Formula C27H25NO4S
Exact Mass 459.150429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3yChbXhkhn2
Name 2-mesityl-N-methyl-1-oxo-N-tosyl-1H-indene-3-carboxamide
Appearance Red crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H25NO4S
InChI InChI=1S/C27H25NO4S/c1-16-10-12-20(13-11-16)33(31,32)28(5)27(30)24-21-8-6-7-9-22(21)26(29)25(24)23-18(3)14-17(2)15-19(23)4/h6-15H,1-5H3
InChIKey RCPJIWHMYKAZLD-UHFFFAOYSA-N
Instrument Name Jeol JMS-700
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.201900996
Molecular Weight 459.560 g/mol
Reported Formula C27H25NO4S
SMILES C1=CC2=C(C=C1)C(C(=C2C(N(C)S(C1=CC=C(C=C1)C)(=O)=O)=O)C1=C(C=C(C=C1C)C)C)=O
SPLASH splash10-0002-0092100000-a9dd73e0fb33968ec6e0
Source of Spectrum QE-25-SM38-2c (DOI: 10.1002/chem.201900996)
Thin-Layer Chromatography 0.31 (PE/EA, 5:1)
Wiley ID 1893842