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4-Chloro-2-({[2-methyl-5-(4-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-nitrophenol
SpectraBase Compound ID CQGnbXEp2QL
InChI InChI=1S/C22H16ClN3O4/c1-12-6-7-14(22-25-20-13(2)4-3-5-19(20)30-22)9-17(12)24-11-15-8-16(23)10-18(21(15)27)26(28)29/h3-11,27H,1-2H3/b24-11+
InChIKey XHBRVJCHEHJLPD-BHGWPJFGSA-N
Mol Weight 421.84 g/mol
Molecular Formula C22H16ClN3O4
Exact Mass 421.082934 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9TDOBtanQAx
Name 4-Chloro-2-({[2-methyl-5-(4-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-nitrophenol
Alternate Name(s) 4-Chloro-2-((E)-{[2-methyl-5-(4-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-6-nitrophenol 4-Chloro-2-[[2-methyl-5-(4-methyl-benzooxazol-2-yl)-phenylimino]-methyl]-6-nitro-phenol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16ClN3O4
InChI InChI=1S/C22H16ClN3O4/c1-12-6-7-14(22-25-20-13(2)4-3-5-19(20)30-22)9-17(12)24-11-15-8-16(23)10-18(21(15)27)26(28)29/h3-11,27H,1-2H3/b24-11+
InChIKey XHBRVJCHEHJLPD-BHGWPJFGSA-N
Molecular Weight 421.840 g/mol
SMILES Oc1c(cc(cc1N(=O)=O)Cl)\C=N\c1c(ccc(c1)-c1oc2cccc(c2n1)C)C
SPLASH splash10-00di-9680100000-6b1848f9965bb850889a
Wiley ID 1438529