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N'-[2-(ethyl)butylamino-5-nitrobenzylidene]-2-(2-bromo-4-
SpectraBase Compound ID 3BscSCc8880
InChI InChI=1S/C22H28BrN5O3/c1-4-6-11-27(5-2)21-10-8-18(28(30)31)13-17(21)14-25-26-22(29)15-24-20-9-7-16(3)12-19(20)23/h7-10,12-14,24H,4-6,11,15H2,1-3H3,(H,26,29)/b25-14+
InChIKey OEQYZZZPYHQBMA-AFUMVMLFSA-N
Mol Weight 490.4 g/mol
Molecular Formula C22H28BrN5O3
Exact Mass 489.137553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A2hIQPosRul
Name N'-[2-(ETHYL)BUTYLAMINO-5-NITROBENZYLIDENE]-2-(2-BROMO-4-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H28BrN5O3
InChI InChI=1S/C22H28BrN5O3/c1-4-6-11-27(5-2)21-10-8-18(28(30)31)13-17(21)14-25-26-22(29)15-24-20-9-7-16(3)12-19(20)23/h7-10,12-14,24H,4-6,11,15H2,1-3H3,(H,26,29)/b25-14+
InChIKey OEQYZZZPYHQBMA-AFUMVMLFSA-N
Molecular Weight 489.1369
SMILES N(C(CNc1ccc(C)cc1Br)=O)\N=C\c1c(N(CCCC)CC)ccc(N(=O)=O)c1
SPLASH splash10-0f89-5980000000-ccea2ae4843403ca5d2d
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany