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5-(N,N-Dimethyl)-2-[4-(N,N-dimetyl)-2-(2-amidoethenyl)benzyl]benzene 2-iodinium
SpectraBase Compound ID 88CkNIWA98P
InChI InChI=1S/C20H24IN3O/c1-23(2)17-8-5-14(15(12-17)7-10-20(22)25)11-16-6-9-18(24(3)4)13-19(16)21/h5-10,12-13H,11H2,1-4H3,(H2,22,25)/b10-7+
InChIKey JTAWLFBLFOQXKL-JXMROGBWSA-N
Mol Weight 449.34 g/mol
Molecular Formula C20H24IN3O
Exact Mass 449.096407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F5ZzdkxXyTJ
Name 5-(N,N-Dimethyl)-2-[4-(N,N-dimetyl)-2-(2-amidoethenyl)benzyl]benzene 2-iodinium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24IN3O
InChI InChI=1S/C20H24IN3O/c1-23(2)17-8-5-14(15(12-17)7-10-20(22)25)11-16-6-9-18(24(3)4)13-19(16)21/h5-10,12-13H,11H2,1-4H3,(H2,22,25)/b10-7+
InChIKey JTAWLFBLFOQXKL-JXMROGBWSA-N
Molecular Weight 449.336 g/mol
SMILES NC(\C=C\c1c(Cc2c(cc(N(C)C)cc2)I)ccc(N(C)C)c1)=O
SPLASH splash10-004w-0598900000-2b5ff0d14df9cfcf2c47
Source of Spectrum F-56-2964-5
Synonyms 5-(N,N-Dimethyl)-2-[4-(N,N-dimethyl)-2-(2-amidoethenyl)benzyl]benzene 2-iodinium
Wiley ID 856788