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[4-Bromo-3-methoxy-2-(3-bromo-2-oxopropyl)-6-nitrophenyl]acetonitrile
SpectraBase Compound ID Whega14pRy
InChI InChI=1S/C12H10Br2N2O4/c1-20-12-9(4-7(17)6-13)8(2-3-15)11(16(18)19)5-10(12)14/h5H,2,4,6H2,1H3
InChIKey RLLWBWYDYZHKIA-UHFFFAOYSA-N
Mol Weight 406.03 g/mol
Molecular Formula C12H10Br2N2O4
Exact Mass 403.900733 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LbsmOEi7w5j
Name [4-Bromo-3-methoxy-2-(3-bromo-2-oxopropyl)-6-nitrophenyl]acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10Br2N2O4
InChI InChI=1S/C12H10Br2N2O4/c1-20-12-9(4-7(17)6-13)8(2-3-15)11(16(18)19)5-10(12)14/h5H,2,4,6H2,1H3
InChIKey RLLWBWYDYZHKIA-UHFFFAOYSA-N
Molecular Weight 406.030 g/mol
SMILES c1(N(=O)=O)c(c(CC(=O)CBr)c(c(c1)Br)OC)CC#N
SPLASH splash10-01c3-0390100000-a5848a7c8550f2785cf1
Source of Spectrum F-53-211-42
Synonyms [4-bromo-2-(3-bromo-2-oxopropyl)-3-methoxy-6-nitrophenyl]acetonitrile 2-[4-bromo-2-(3-bromo-2-oxopropyl)-3-methoxy-6-nitrophenyl]acetonitrile 2-[4-bromo-2-(3-bromo-2-oxo-propyl)-3-methoxy-6-nitro-phenyl]acetonitrile 2-[4-bromanyl-2-(3-bromanyl-2-oxidanylidene-propyl)-3-methoxy-6-nitro-phenyl]ethanenitrile
Wiley ID 799853