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Ethylene bis-[3-(4-chlorophenyl)-4,6-dimethoxyindole-7-carboxylate]
SpectraBase Compound ID 1TI5sJiNzAW
InChI InChI=1S/C36H30Cl2N2O8/c1-43-25-15-27(45-3)31(33-29(25)23(17-39-33)19-5-9-21(37)10-6-19)35(41)47-13-14-48-36(42)32-28(46-4)16-26(44-2)30-24(18-40-34(30)32)20-7-11-22(38)12-8-20/h5-12,15-18,39-40H,13-14H2,1-4H3
InChIKey CVYVGLPCKNRKCP-UHFFFAOYSA-N
Mol Weight 689.5 g/mol
Molecular Formula C36H30Cl2N2O8
Exact Mass 688.137921 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7AJkMzg3Hqc
Name Ethylene bis-[3-(4-chlorophenyl)-4,6-dimethoxyindole-7-carboxylate]
Appearance Colorless crystals
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Formula C36H30Cl2N2O8
InChI InChI=1S/C36H30Cl2N2O8/c1-43-25-15-27(45-3)31(33-29(25)23(17-39-33)19-5-9-21(37)10-6-19)35(41)47-13-14-48-36(42)32-28(46-4)16-26(44-2)30-24(18-40-34(30)32)20-7-11-22(38)12-8-20/h5-12,15-18,39-40H,13-14H2,1-4H3
InChIKey CVYVGLPCKNRKCP-UHFFFAOYSA-N
Instrument Name VG Quattro
Ionization Type EI positive ion
Literature Reference DOI 10.24820/ark.5550190.p011.708
SMILES N1C=C(C=2C1=C(C(OCCOC(C1=C(C=C(C3=C1NC=C3C1=CC=C(C=C1)Cl)OC)OC)=O)=O)C(=CC2OC)OC)C1=CC=C(C=C1)Cl
SPLASH splash10-03di-0009002000-a55f66efbcb63d545448
Source of Spectrum ARK-2022-75-2 (DOI: 10.24820/ark.5550190.p011.708)
Wiley ID 1896882