CID 14088945

5-bromo-n4,n4-dimethylpyridine-2,4-diamine

Structural Information

Molecular Formula
C7H10BrN3
SMILES
CN(C)C1=CC(=NC=C1Br)N
InChI
InChI=1S/C7H10BrN3/c1-11(2)6-3-7(9)10-4-5(6)8/h3-4H,1-2H3,(H2,9,10)
InChIKey
KWQUOMOSGQWJLX-UHFFFAOYSA-N
Compound name
5-bromo-4-N,4-N-dimethylpyridine-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.00581 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.013086 136.6
[M+Na]+ 237.995028 148.0
[M-H]- 213.998534 142.8
[M+NH4]+ 233.039633 157.6
[M+K]+ 253.968968 137.7
[M+H-H2O]+ 198.003070 135.0
[M+HCOO]- 260.004011 159.6
[M+CH3COO]- 274.019661 192.6
[M+Na-2H]- 235.980476 144.2
[M]+ 215.00526142 154.2
[M]- 215.00635858 154.2
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.