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3H-Indole, 3-[(3,4-dimethoxyphenyl)methylidene]-1,2-dihydro-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-
SpectraBase Compound ID 1l4cjoJNL3m
InChI InChI=1S/C24H21N3O8S/c1-15-4-7-19(8-5-15)36(32,33)25-14-17(10-16-6-9-22(34-2)23(11-16)35-3)24-20(25)12-18(26(28)29)13-21(24)27(30)31/h4-13H,14H2,1-3H3/b17-10+
InChIKey UJZJJDYSZSEUNU-LICLKQGHSA-N
Mol Weight 511.51 g/mol
Molecular Formula C24H21N3O8S
Exact Mass 511.104936 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Y8JIwasPzJ
Name 3H-Indole, 3-[(3,4-dimethoxyphenyl)methylidene]-1,2-dihydro-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H21N3O8S
InChI InChI=1S/C24H21N3O8S/c1-15-4-7-19(8-5-15)36(32,33)25-14-17(10-16-6-9-22(34-2)23(11-16)35-3)24-20(25)12-18(26(28)29)13-21(24)27(30)31/h4-13H,14H2,1-3H3/b17-10+
InChIKey UJZJJDYSZSEUNU-LICLKQGHSA-N
Molecular Weight 511.505 g/mol
SMILES COc1c(cc(\C=C/2CN(S(c3ccc(C)cc3)(=O)=O)c3c2c(N(=O)=O)cc(N(=O)=O)c3)cc1)OC
SPLASH splash10-052f-9532000000-66e5f0c90e70f8cb1e2a
Source of Spectrum IY-1-4603-8
Synonyms (3Z)-3-[(3,4-dimethoxyphenyl)methylene]-4,6-dinitro-1-(p-tolylsulfonyl)indoline (3Z)-3-[(3,4-dimethoxyphenyl)methylidene]-1-(4-methylphenyl)sulfonyl-4,6-dinitro-2H-indole
Wiley ID 1654021