CID 51060033

882864-72-4

Structural Information

Molecular Formula
C17H22N4
SMILES
CCCC(C)NC1=C2C(=NN(C2=NC3=CC=CC=C31)C)C
InChI
InChI=1S/C17H22N4/c1-5-8-11(2)18-16-13-9-6-7-10-14(13)19-17-15(16)12(3)20-21(17)4/h6-7,9-11H,5,8H2,1-4H3,(H,18,19)
InChIKey
QZXKRRYQMIKDAJ-UHFFFAOYSA-N
Compound name
1,3-dimethyl-N-pentan-2-ylpyrazolo[3,4-b]quinolin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.18445 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.19173 168.4
[M+Na]+ 305.17367 182.8
[M+NH4]+ 300.21827 176.5
[M+K]+ 321.14761 176.6
[M-H]- 281.17717 170.9
[M+Na-2H]- 303.15912 173.9
[M]+ 282.18390 171.2
[M]- 282.18500 171.2
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.