CID 39243548

6-bromo-n1,n1-dimethylbenzene-1,3-diamine

Structural Information

Molecular Formula
C8H11BrN2
SMILES
CN(C)C1=C(C=CC(=C1)N)Br
InChI
InChI=1S/C8H11BrN2/c1-11(2)8-5-6(10)3-4-7(8)9/h3-5H,10H2,1-2H3
InChIKey
CFLRRCADOHKXQE-UHFFFAOYSA-N
Compound name
4-bromo-3-N,3-N-dimethylbenzene-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

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References

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Patents

214.01056 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.01784 137.5
[M+Na]+ 236.99978 140.4
[M+NH4]+ 232.04438 143.1
[M+K]+ 252.97372 140.5
[M-H]- 213.00328 139.8
[M+Na-2H]- 234.98523 141.8
[M]+ 214.01001 137.4
[M]- 214.01111 137.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.