CID 23250506

5-bromo-n,n,4,6-tetramethylpyridin-2-amine

Structural Information

Molecular Formula
C9H13BrN2
SMILES
CC1=CC(=NC(=C1Br)C)N(C)C
InChI
InChI=1S/C9H13BrN2/c1-6-5-8(12(3)4)11-7(2)9(6)10/h5H,1-4H3
InChIKey
CISMTWZQYSPXPU-UHFFFAOYSA-N
Compound name
5-bromo-N,N,4,6-tetramethylpyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

228.02621 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.03349 140.2
[M+Na]+ 251.01543 152.8
[M-H]- 227.01893 147.2
[M+NH4]+ 246.06003 161.8
[M+K]+ 266.98937 142.7
[M+H-H2O]+ 211.02347 139.4
[M+HCOO]- 273.02441 162.4
[M+CH3COO]- 287.04006 195.4
[M+Na-2H]- 249.00088 147.1
[M]+ 228.02566 160.7
[M]- 228.02676 160.7
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

patents stripe