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]+ 216.01309 136.6
[M+Na]+ 237.99503 148.0
[M-H]- 213.99853 142.8
[M+NH4]+ 233.03963 157.6
[M+K]+ 253.96897 137.7
[M+H-H2O]+ 198.00307 135.0
[M+HCOO]- 260.00401 159.6
[M+CH3COO]- 274.01966 192.6
[M+Na-2H]- 235.98048 144.2
[M]+ 215.00526 154.2
[M]- 215.00636 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.