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1-(4-Methylphenyl)-5-[N-(4-methylphenyl)-N-(3-chlorobenzoyl)amino]tetrazole
SpectraBase Compound ID H08phERZGKs
InChI InChI=1S/C22H18ClN5O/c1-15-6-10-19(11-7-15)27(21(29)17-4-3-5-18(23)14-17)22-24-25-26-28(22)20-12-8-16(2)9-13-20/h3-14H,1-2H3
InChIKey ABWIREHWYJJLPW-UHFFFAOYSA-N
Mol Weight 403.87 g/mol
Molecular Formula C22H18ClN5O
Exact Mass 403.119988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J2VNtaia52a
Name 1-(4-Methylphenyl)-5-[N-(4-methylphenyl)-N-(3-chlorobenzoyl)amino]tetrazole
Alternate Name(s) 3-Chloro-N-(4-methylphenyl)-N-[1-(4-methylphenyl)-1H-tetraazol-5-yl]benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18ClN5O
InChI InChI=1S/C22H18ClN5O/c1-15-6-10-19(11-7-15)27(21(29)17-4-3-5-18(23)14-17)22-24-25-26-28(22)20-12-8-16(2)9-13-20/h3-14H,1-2H3
InChIKey ABWIREHWYJJLPW-UHFFFAOYSA-N
Molecular Weight 403.873 g/mol
SMILES c1(nnn[n]1-c1ccc(cc1)C)N(C(c1cc(ccc1)Cl)=O)c1ccc(cc1)C
SPLASH splash10-0a73-4900000000-e0a3db680f8cfb20de24
Source of Spectrum SO-0-824-3
Wiley ID 1539557