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1,1'-(1-(4-Chlorophenyl)-5-methyl-1H-pyrazole-3,4-diyl)-bis(3-(4-methoxyphenyl)prop-2-en-1-one)
SpectraBase Compound ID 4T3H6JzXRrs
InChI InChI=1S/C30H25ClN2O4/c1-20-29(27(34)18-8-21-4-14-25(36-2)15-5-21)30(32-33(20)24-12-10-23(31)11-13-24)28(35)19-9-22-6-16-26(37-3)17-7-22/h4-19H,1-3H3/b18-8+,19-9+
InChIKey JFOLEEZLOQAZMN-GCBPPVMSSA-N
Mol Weight 512.99 g/mol
Molecular Formula C30H25ClN2O4
Exact Mass 512.150285 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Rq7xc7NWuk
Name 1,1'-(1-(4-Chlorophenyl)-5-methyl-1H-pyrazole-3,4-diyl)-bis(3-(4-methoxyphenyl)prop-2-en-1-one)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H25ClN2O4
InChI InChI=1S/C30H25ClN2O4/c1-20-29(27(34)18-8-21-4-14-25(36-2)15-5-21)30(32-33(20)24-12-10-23(31)11-13-24)28(35)19-9-22-6-16-26(37-3)17-7-22/h4-19H,1-3H3/b18-8+,19-9+
InChIKey JFOLEEZLOQAZMN-GCBPPVMSSA-N
Literature Reference DOI 10.1002/ardp.201300193
Molecular Weight 512.993 g/mol
SMILES c1(n[n](c(c1C(\C=C\c1ccc(cc1)OC)=O)C)-c1ccc(cc1)Cl)C(=O)\C=C\c1ccc(cc1)OC
SPLASH splash10-0fau-7904010000-aaa7a3a2cc32ceff624b
Source of Spectrum APC-346-694-3c
Synonyms (2E,2'E)-1,1'-(1-(4-chlorophenyl)-5-methyl-1H-pyrazole-3,4-diyl)bis(3-(4-methoxyphenyl)prop-2-en-1-one) (E)-1-[1-(4-chlorophenyl)-3-[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]-5-methyl-4-pyrazolyl]-3-(4-methoxyphenyl)-2-propen-1-one (E)-1-[1-(4-chlorophenyl)-3-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]-5-methylpyrazol-4-yl]-3-(4-methoxyphenyl)prop-2-en-1-one (E)-1-[1-(4-chlorophenyl)-3-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]-5-methyl-pyrazol-4-yl]-3-(4-methoxyphenyl)prop-2-en-1-one
Wiley ID 1769566