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1-(Dimethylamino)-5-{[4'-(5"-<4"'-iodophenyl>ethynyl|)-1"-naphthylethynyl]-1'-phenylethynyl}-naphthalene
SpectraBase Compound ID BxPYqdP0ecZ
InChI InChI=1S/C40H26IN/c1-42(2)40-14-6-12-38-34(9-5-13-39(38)40)26-20-30-17-15-29(16-18-30)19-24-32-7-3-11-37-33(8-4-10-36(32)37)25-21-31-22-27-35(41)28-23-31/h3-18,22-23,27-28H,1-2H3
InChIKey KRYHBLDTCLEXDW-UHFFFAOYSA-N
Mol Weight 647.6 g/mol
Molecular Formula C40H26IN
Exact Mass 647.110995 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8aQ1XY98EVv
Name 1-(Dimethylamino)-5-{[4'-(5"-<4"'-iodophenyl>ethynyl|)-1"-naphthylethynyl]-1'-phenylethynyl}-naphthalene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H26IN
InChI InChI=1S/C40H26IN/c1-42(2)40-14-6-12-38-34(9-5-13-39(38)40)26-20-30-17-15-29(16-18-30)19-24-32-7-3-11-37-33(8-4-10-36(32)37)25-21-31-22-27-35(41)28-23-31/h3-18,22-23,27-28H,1-2H3
InChIKey KRYHBLDTCLEXDW-UHFFFAOYSA-N
Molecular Weight 647.559 g/mol
SMILES C(#Cc1ccc(C#Cc2c3c(c(C#Cc4ccc(cc4)I)ccc3)ccc2)cc1)c1c2c(c(N(C)C)ccc2)ccc1
SPLASH splash10-0002-0001009000-72a0d0fdac78c0874f60
Source of Spectrum H-2005-367-11
Synonyms 5-[2-[4-[2-[5-[2-(4-iodophenyl)ethynyl]-1-naphthalenyl]ethynyl]phenyl]ethynyl]-N,N-dimethyl-1-naphthalenamine 5-[2-[4-[2-[5-[2-(4-iodophenyl)ethynyl]naphthalen-1-yl]ethynyl]phenyl]ethynyl]-N,N-dimethylnaphthalen-1-amine 5-[2-[4-[2-[5-[2-(4-iodophenyl)ethynyl]-1-naphthyl]ethynyl]phenyl]ethynyl]-N,N-dimethyl-naphthalen-1-amine 5-[2-[4-[2-[5-[2-(4-iodophenyl)ethynyl]naphthalen-1-yl]ethynyl]phenyl]ethynyl]-N,N-dimethyl-naphthalen-1-amine
Wiley ID 1562150