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2-[2-(2-Chloro-2-(4-bromophenyl))ethenyl]-1-methylpyrrolenium perchlorate
SpectraBase Compound ID 431yDdrvjXA
InChI InChI=1S/C13H14BrClN.ClHO4/c1-16-8-2-3-12(16)9-13(15)10-4-6-11(14)7-5-10;2-1(3,4)5/h4-7,9H,2-3,8H2,1H3;(H,2,3,4,5)/q+1;/p-1/b13-9-;
InChIKey JSVUIVPEHPHLCU-CHHCPSLASA-M
Mol Weight 399.07 g/mol
Molecular Formula C13H14BrCl2NO4
Exact Mass 396.948326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DiYdk0TUeIO
Name 2-[2-(2-Chloro-2-(4-bromophenyl))ethenyl]-1-methylpyrrolenium perchlorate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14BrCl2NO4
InChI InChI=1S/C13H14BrClN.ClHO4/c1-16-8-2-3-12(16)9-13(15)10-4-6-11(14)7-5-10;2-1(3,4)5/h4-7,9H,2-3,8H2,1H3;(H,2,3,4,5)/q+1;/p-1/b13-9-;
InChIKey JSVUIVPEHPHLCU-CHHCPSLASA-M
Molecular Weight 399.068 g/mol
SMILES C1(=[N+](CCC1)C)\C=C\(c1ccc(cc1)Br)Cl.[Cl]([O-])(=O)(=O)=O
SPLASH splash10-000i-9420000000-b1c5b7a87f27e18af994
Source of Spectrum SO-0-1154-6
Wiley ID 1542753