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1,1'-(5-Methyl-1-(4-methylphenyl)-1H-pyrazole-3,4-diyl)-bis-(3-(2,4-dichlorophenyl)prop-2-en-1-one)
SpectraBase Compound ID GoAbHTpFxGI
InChI InChI=1S/C29H20Cl4N2O2/c1-17-3-11-23(12-4-17)35-18(2)28(26(36)13-7-19-5-9-21(30)15-24(19)32)29(34-35)27(37)14-8-20-6-10-22(31)16-25(20)33/h3-16H,1-2H3/b13-7+,14-8+
InChIKey UDPSPUHTSKYLLL-FNCQTZNRSA-N
Mol Weight 570.3 g/mol
Molecular Formula C29H20Cl4N2O2
Exact Mass 568.027889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JF0xigalwTX
Name 1,1'-(5-Methyl-1-(4-methylphenyl)-1H-pyrazole-3,4-diyl)-bis-(3-(2,4-dichlorophenyl)prop-2-en-1-one)
Alternate Name(s) (2E,2'E)-1,1'-(5-methyl-1-(p-tolyl)-1H-pyrazole-3,4-diyl)bis(3-(2,4-dichlorophenyl)prop-2-en-1-one) (E)-3-(2,4-dichlorophenyl)-1-[3-[(E)-3-(2,4-dichlorophenyl)-1-oxoprop-2-enyl]-5-methyl-1-(4-methylphenyl)-4-pyrazolyl]-2-propen-1-one (E)-3-(2,4-dichlorophenyl)-1-[3-[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]-5-methyl-1-(p-tolyl)pyrazol-4-yl]prop-2-en-1-one (E)-3-(2,4-dichlorophenyl)-1-[3-[(E)-3-(2,4-dichlorophenyl)prop-2-enoyl]-5-methyl-1-(4-methylphenyl)pyrazol-4-yl]prop-2-en-1-one
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Formula C29H20Cl4N2O2
InChI InChI=1S/C29H20Cl4N2O2/c1-17-3-11-23(12-4-17)35-18(2)28(26(36)13-7-19-5-9-21(30)15-24(19)32)29(34-35)27(37)14-8-20-6-10-22(31)16-25(20)33/h3-16H,1-2H3/b13-7+,14-8+
InChIKey UDPSPUHTSKYLLL-FNCQTZNRSA-N
Literature Reference DOI 10.1002/ardp.201300193
Molecular Weight 570.303 g/mol
SMILES c1(n[n](c(c1C(\C=C\c1c(cc(cc1)Cl)Cl)=O)C)-c1ccc(cc1)C)C(=O)\C=C\c1ccc(cc1Cl)Cl
SPLASH splash10-000i-0300090000-55bbb945be59ff659268
Source of Spectrum APC-346-694-3b
Wiley ID 1769565