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3H-Indole, 1,2-dihydro-3-[(4-methoxyphenyl)methylidene]-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-
SpectraBase Compound ID BNLsGX4MODz
InChI InChI=1S/C23H19N3O7S/c1-15-3-9-20(10-4-15)34(31,32)24-14-17(11-16-5-7-19(33-2)8-6-16)23-21(24)12-18(25(27)28)13-22(23)26(29)30/h3-13H,14H2,1-2H3/b17-11+
InChIKey ZZEHJDWJFBMJAH-GZTJUZNOSA-N
Mol Weight 481.48 g/mol
Molecular Formula C23H19N3O7S
Exact Mass 481.094371 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HWhAidG7V2c
Name 3H-Indole, 1,2-dihydro-3-[(4-methoxyphenyl)methylidene]-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-
Alternate Name(s) (3Z)-3-[(4-methoxyphenyl)methylene]-4,6-dinitro-1-(p-tolylsulfonyl)indoline (3Z)-3-[(4-methoxyphenyl)methylidene]-1-(4-methylphenyl)sulfonyl-4,6-dinitro-2H-indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H19N3O7S
InChI InChI=1S/C23H19N3O7S/c1-15-3-9-20(10-4-15)34(31,32)24-14-17(11-16-5-7-19(33-2)8-6-16)23-21(24)12-18(25(27)28)13-22(23)26(29)30/h3-13H,14H2,1-2H3/b17-11+
InChIKey ZZEHJDWJFBMJAH-GZTJUZNOSA-N
Molecular Weight 481.479 g/mol
SMILES COc1ccc(\C=C/2CN(S(c3ccc(cc3)C)(=O)=O)c3c2c(N(=O)=O)cc(N(=O)=O)c3)cc1
SPLASH splash10-005c-8987100000-2eb89d4042a22ab76056
Source of Spectrum IY-1-4603-3
Wiley ID 1654016