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(E)-(1-benzoylcyclopropyl)(3-iodo-5-methyl-2-(pyrrolidin-1-yldiazenyl)phenyl)methanone
SpectraBase Compound ID EdE4mQu2I8k
InChI InChI=1S/C22H22IN3O2/c1-15-13-17(19(18(23)14-15)24-25-26-11-5-6-12-26)21(28)22(9-10-22)20(27)16-7-3-2-4-8-16/h2-4,7-8,13-14H,5-6,9-12H2,1H3/b25-24+
InChIKey HPOQJUJQLIAPFW-OCOZRVBESA-N
Mol Weight 487.34 g/mol
Molecular Formula C22H22IN3O2
Exact Mass 487.075672 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JbXOvYEu35H
Name (E)-(1-benzoylcyclopropyl)(3-iodo-5-methyl-2-(pyrrolidin-1-yldiazenyl)phenyl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22IN3O2
InChI InChI=1S/C22H22IN3O2/c1-15-13-17(19(18(23)14-15)24-25-26-11-5-6-12-26)21(28)22(9-10-22)20(27)16-7-3-2-4-8-16/h2-4,7-8,13-14H,5-6,9-12H2,1H3/b25-24+
InChIKey HPOQJUJQLIAPFW-OCOZRVBESA-N
Literature Reference DOI 10.1021/ol400223d
Molecular Weight 487.341 g/mol
SMILES C1(CC1)(C(c1ccccc1)=O)C(=O)c1c(c(cc(c1)C)I)\N=N\N1CCCC1
SPLASH splash10-0a6r-5913300000-bb9c1668aa9c204692fa
Source of Spectrum A1-15-1282/SM14-1_2m
Wiley ID 1748409