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N'-(3-nitrobenzoylmethylene)-2-(2,6-dibromo-4-
SpectraBase Compound ID 5cJJoeoCnMf
InChI InChI=1S/C17H13Br2N3O5/c1-10-6-12(18)17(13(19)7-10)27-9-16(24)21-20-8-15(23)11-4-2-3-5-14(11)22(25)26/h2-8H,9H2,1H3,(H,21,24)/b20-8+
InChIKey JCUJDRSJUJMBSZ-DNTJNYDQSA-N
Mol Weight 499.12 g/mol
Molecular Formula C17H13Br2N3O5
Exact Mass 496.922197 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4n52jwrmAFN
Name N'-(3-NITROBENZOYLMETHYLENE)-2-(2,6-DIBROMO-4-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H13Br2N3O5
InChI InChI=1S/C17H13Br2N3O5/c1-10-6-12(18)17(13(19)7-10)27-9-16(24)21-20-8-15(23)11-4-2-3-5-14(11)22(25)26/h2-8H,9H2,1H3,(H,21,24)/b20-8+
InChIKey JCUJDRSJUJMBSZ-DNTJNYDQSA-N
Molecular Weight 496.9218
SMILES N(\N=C\C(c1ccccc1N(=O)=O)=O)C(=O)COc1c(Br)cc(C)cc1Br
SPLASH splash10-0udi-9800000000-02ac12f3c34bc9ca7c1c
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany