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N-[(4-Fluorophenyl)-(1,2,4-triazol-yl)methyl]methylene O-2-(2-methylphenyl-1-methoxyacrylate) oxime
SpectraBase Compound ID 2SNqfYVvEAm
InChI InChI=1S/C22H21FN4O4/c1-29-13-20(22(28)30-2)19-6-4-3-5-17(19)12-31-26-21(11-27-15-24-14-25-27)16-7-9-18(23)10-8-16/h3-10,13-15H,11-12H2,1-2H3/b20-13+,26-21-
InChIKey HWVNSEMXPSHKQA-YEQFLVNDSA-N
Mol Weight 424.43 g/mol
Molecular Formula C22H21FN4O4
Exact Mass 424.154683 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 710cJHzxDDu
Name N-[(4-Fluorophenyl)-(1,2,4-triazol-yl)methyl]methylene O-2-(2-methylphenyl-1-methoxyacrylate) oxime
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21FN4O4
InChI InChI=1S/C22H21FN4O4/c1-29-13-20(22(28)30-2)19-6-4-3-5-17(19)12-31-26-21(11-27-15-24-14-25-27)16-7-9-18(23)10-8-16/h3-10,13-15H,11-12H2,1-2H3/b20-13+,26-21-
InChIKey HWVNSEMXPSHKQA-YEQFLVNDSA-N
Molecular Weight 424.432 g/mol
SMILES c1(\C(C(=O)OC)=C/OC)c(CO\N=C\(C[n]2ncnc2)c2ccc(cc2)F)cccc1
SPLASH splash10-0002-0910000000-8b1721d0d1ac10397590
Source of Spectrum Y-51-1605-3g
Synonyms N-[(4-Fluorophenyl)-(1,2,4-triazol-yl)methyl]methylene O-2-(2-methylphenyl-1-methoxyacryllate) oxime (E)-methyl 2-(2-((((E)-(1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethylidene)amino)oxy)methyl)phenyl)-3-methoxyacrylate
Wiley ID 1741662