CID 21328759

2,5-dibromobenzene-1,4-diamine

Structural Information

Molecular Formula
C6H6Br2N2
SMILES
C1=C(C(=CC(=C1Br)N)Br)N
InChI
InChI=1S/C6H6Br2N2/c7-3-1-5(9)4(8)2-6(3)10/h1-2H,9-10H2
InChIKey
MJFBGMMDLNKGNC-UHFFFAOYSA-N
Compound name
2,5-dibromobenzene-1,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

105
Patents

263.88977 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.89705 144.8
[M+Na]+ 286.87899 139.7
[M+NH4]+ 281.92359 147.0
[M+K]+ 302.85293 146.1
[M-H]- 262.88249 146.3
[M+Na-2H]- 284.86444 146.3
[M]+ 263.88922 143.3
[M]- 263.89032 143.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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