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4-Bromo-5-[2-(dimethylamino)ethenyl]benzene-1,2-dicarbonitrile

View entire compound with spectra: 1 FTIR

4-Bromo-5-[2-(dimethylamino)ethenyl]benzene-1,2-dicarbonitrile
SpectraBase Compound ID 4evNzBW3L6d
InChI InChI=1S/C12H10BrN3/c1-16(2)4-3-9-5-10(7-14)11(8-15)6-12(9)13/h3-6H,1-2H3/b4-3+
InChIKey COXJPCXNCSKRJG-ONEGZZNKSA-N
Mol Weight 276.14 g/mol
Molecular Formula C12H10BrN3
Exact Mass 275.00581 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KAZBVzkh5qL
Name 4-Bromo-5-[2-(dimethylamino)ethenyl]benzene-1,2-dicarbonitrile
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 275.005810334 u
Formula C12H10BrN3
InChI InChI=1S/C12H10BrN3/c1-16(2)4-3-9-5-10(7-14)11(8-15)6-12(9)13/h3-6H,1-2H3/b4-3+
InChIKey COXJPCXNCSKRJG-ONEGZZNKSA-N
SMILES C1(C#N)=CC(\C=C\N(C)C)=C(C=C1C#N)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.881896