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[2-(3-CHLOROPHENYLAMINO)-1-CYClOPENTEN-1-YL]-[5-CHLORO-1-(4-METHOXYPHENYLMETHYL)-1-H-1,2,3-TRIAZOL-4-YL]-METHANONE
SpectraBase Compound ID E8kTbb06xq5
InChI InChI=1S/C22H20Cl2N4O2/c1-30-17-10-8-14(9-11-17)13-28-22(24)20(26-27-28)21(29)18-6-3-7-19(18)25-16-5-2-4-15(23)12-16/h2,4-5,8-12,25H,3,6-7,13H2,1H3
InChIKey SKBCHTCFFXHCOS-UHFFFAOYSA-N
Mol Weight 443.33 g/mol
Molecular Formula C22H20Cl2N4O2
Exact Mass 442.096331 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 72HCLJ0npD4
Name [2-(3-chloroanilino)-1-cyclopentenyl]-[5-chloro-1-[(4-methoxyphenyl)methyl]-4-triazolyl]methanone
Alternate Name(s) [2-(3-chloroanilino)cyclopenten-1-yl]-(5-chloro-1-p-anisyl-triazol-4-yl)methanone [2-(3-chloroanilino)cyclopenten-1-yl]-[5-chloro-1-[(4-methoxyphenyl)methyl]triazol-4-yl]methanone [5-chloranyl-1-[(4-methoxyphenyl)methyl]-1,2,3-triazol-4-yl]-[2-[(3-chlorophenyl)amino]cyclopenten-1-yl]methanone
CAS Registry Number 129609-25-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20Cl2N4O2
InChI InChI=1S/C22H20Cl2N4O2/c1-30-17-10-8-14(9-11-17)13-28-22(24)20(26-27-28)21(29)18-6-3-7-19(18)25-16-5-2-4-15(23)12-16/h2,4-5,8-12,25H,3,6-7,13H2,1H3
InChIKey SKBCHTCFFXHCOS-UHFFFAOYSA-N
Molecular Weight 443.334 g/mol
SMILES N(C1=C(C(c2c([n](Cc3ccc(cc3)OC)nn2)Cl)=O)CCC1)c1cc(Cl)ccc1
SPLASH splash10-00di-0900100000-0ca149ec342109553ff7
Source of Spectrum Y-27-1138-7
Wiley ID 1385245