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4-({[3-hydroxy-4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)phenyl 4-iodobenzoate
SpectraBase Compound ID Hq0d5GbFyNN
InChI InChI=1S/C28H19IN2O4/c1-17-2-13-26-24(14-17)31-27(35-26)23-12-9-21(15-25(23)32)30-16-18-3-10-22(11-4-18)34-28(33)19-5-7-20(29)8-6-19/h2-16,32H,1H3/b30-16+
InChIKey MKWHYNSNIZSKPV-OKCVXOCRSA-N
Mol Weight 574.37 g/mol
Molecular Formula C28H19IN2O4
Exact Mass 574.038952 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IX1MKrokrX
Name 4-({[3-hydroxy-4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)phenyl 4-iodobenzoate
Alternate Name(s) 4-((E)-{[3-hydroxy-4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl)phenyl 4-iodobenzoate 4-iodo-benzoic acid 4-[[3-hydroxy-4-(5-methyl-benzooxazol-2-yl)-phenylimino]-methyl]-phenyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H19IN2O4
InChI InChI=1S/C28H19IN2O4/c1-17-2-13-26-24(14-17)31-27(35-26)23-12-9-21(15-25(23)32)30-16-18-3-10-22(11-4-18)34-28(33)19-5-7-20(29)8-6-19/h2-16,32H,1H3/b30-16+
InChIKey MKWHYNSNIZSKPV-OKCVXOCRSA-N
Molecular Weight 574.374 g/mol
SMILES Oc1c(ccc(c1)\N=C\c1ccc(cc1)OC(=O)c1ccc(cc1)I)-c1nc2cc(ccc2o1)C
SPLASH splash10-000x-9220000000-4934ce39ed5f58d4b7fc
Wiley ID 1438509