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3-iodo-2-[di(m-nitrophenyl)amino]-1,4-naphthoquinone
SpectraBase Compound ID HKiNzHIBTtI
InChI InChI=1S/C22H12IN3O6/c23-19-20(22(28)18-10-2-1-9-17(18)21(19)27)24(13-5-3-7-15(11-13)25(29)30)14-6-4-8-16(12-14)26(31)32/h1-12H
InChIKey CSXNCLSKKJOLLW-UHFFFAOYSA-N
Mol Weight 541.26 g/mol
Molecular Formula C22H12IN3O6
Exact Mass 540.97708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D5VmvhA7DwZ
Name 3-iodo-2-[di(m-nitrophenyl)amino]-1,4-naphthoquinone
Alternate Name(s) 2-[bis(3-nitrophenyl)amino]-3-iodonaphthoquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H12IN3O6
InChI InChI=1S/C22H12IN3O6/c23-19-20(22(28)18-10-2-1-9-17(18)21(19)27)24(13-5-3-7-15(11-13)25(29)30)14-6-4-8-16(12-14)26(31)32/h1-12H
InChIKey CSXNCLSKKJOLLW-UHFFFAOYSA-N
Molecular Weight 541.257 g/mol
SMILES C1(=C(C(=O)c2c(C1=O)cccc2)I)N(c1cc(N(=O)=O)ccc1)c1cc(N(=O)=O)ccc1
SPLASH splash10-0a4i-0900230000-91bd6348f8f70d634c3b
Source of Spectrum F-53-6109-22
Wiley ID 801953