CID 65103257

1-[(4-aminopyridin-2-yl)amino]-2-methylpropan-2-ol

Structural Information

Molecular Formula
C9H15N3O
SMILES
CC(C)(CNC1=NC=CC(=C1)N)O
InChI
InChI=1S/C9H15N3O/c1-9(2,13)6-12-8-5-7(10)3-4-11-8/h3-5,13H,6H2,1-2H3,(H3,10,11,12)
InChIKey
GZIQHUCQRGBGBE-UHFFFAOYSA-N
Compound name
1-[(4-aminopyridin-2-yl)amino]-2-methylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

181.1215 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.12878 140.6
[M+Na]+ 204.11072 147.2
[M-H]- 180.11422 141.3
[M+NH4]+ 199.15532 157.9
[M+K]+ 220.08466 144.7
[M+H-H2O]+ 164.11876 134.2
[M+HCOO]- 226.11970 162.4
[M+CH3COO]- 240.13535 184.1
[M+Na-2H]- 202.09617 147.9
[M]+ 181.12095 137.9
[M]- 181.12205 137.9
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