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3H-Indole, 3-[(4-ethoxyphenyl)methylidene]-1,2-dihydro-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-
SpectraBase Compound ID 8vHKuzNOotB
InChI InChI=1S/C24H21N3O7S/c1-3-34-20-8-6-17(7-9-20)12-18-15-25(35(32,33)21-10-4-16(2)5-11-21)22-13-19(26(28)29)14-23(24(18)22)27(30)31/h4-14H,3,15H2,1-2H3/b18-12+
InChIKey NLEFDMBJIZNHFV-LDADJPATSA-N
Mol Weight 495.51 g/mol
Molecular Formula C24H21N3O7S
Exact Mass 495.110021 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FzUVIUtVPU
Name 3H-Indole, 3-[(4-ethoxyphenyl)methylidene]-1,2-dihydro-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H21N3O7S
InChI InChI=1S/C24H21N3O7S/c1-3-34-20-8-6-17(7-9-20)12-18-15-25(35(32,33)21-10-4-16(2)5-11-21)22-13-19(26(28)29)14-23(24(18)22)27(30)31/h4-14H,3,15H2,1-2H3/b18-12+
InChIKey NLEFDMBJIZNHFV-LDADJPATSA-N
Molecular Weight 495.506 g/mol
SMILES c12c(cc(cc2N(=O)=O)N(=O)=O)N(C\C1=C\c1ccc(cc1)OCC)S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-0006-9311000000-a1818d04071dafbbf7ff
Source of Spectrum IY-1-4491-3
Synonyms (3Z)-3-[(4-ethoxyphenyl)methylene]-4,6-dinitro-1-(p-tolylsulfonyl)indoline (3Z)-3-[(4-ethoxyphenyl)methylidene]-1-(4-methylphenyl)sulfonyl-4,6-dinitro-2H-indole
Wiley ID 1652896