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2-[2-(2-Chloro-2-(4-nitrophenyl))ethenyl]-1-methylpyrrolenium perchlorate
SpectraBase Compound ID B14Y2hIMfiA
InChI InChI=1S/C13H14ClN2O2.ClHO4/c1-15-8-2-3-12(15)9-13(14)10-4-6-11(7-5-10)16(17)18;2-1(3,4)5/h4-7,9H,2-3,8H2,1H3;(H,2,3,4,5)/q+1;/p-1/b13-9-;
InChIKey LWJJIBRYKDGWRD-CHHCPSLASA-M
Mol Weight 365.17 g/mol
Molecular Formula C13H14Cl2N2O6
Exact Mass 364.022892 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3mo2jMfpBA0
Name 2-[2-(2-Chloro-2-(4-nitrophenyl))ethenyl]-1-methylpyrrolenium perchlorate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14Cl2N2O6
InChI InChI=1S/C13H14ClN2O2.ClHO4/c1-15-8-2-3-12(15)9-13(14)10-4-6-11(7-5-10)16(17)18;2-1(3,4)5/h4-7,9H,2-3,8H2,1H3;(H,2,3,4,5)/q+1;/p-1/b13-9-;
InChIKey LWJJIBRYKDGWRD-CHHCPSLASA-M
Molecular Weight 365.169 g/mol
SMILES C1(=[N+](CCC1)C)\C=C\(c1ccc(N(=O)=O)cc1)Cl.[Cl]([O-])(=O)(=O)=O
SPLASH splash10-000i-9410000000-2165ddbed12f15ed141e
Source of Spectrum SO-0-1154-6
Wiley ID 1542752