CID 13762597

112447-03-7

Structural Information

Molecular Formula
C14H15N3O2
SMILES
CC1=NN(C2=C1C(=O)C3=C(N2C)C=CC(=C3)OC)C
InChI
InChI=1S/C14H15N3O2/c1-8-12-13(18)10-7-9(19-4)5-6-11(10)16(2)14(12)17(3)15-8/h5-7H,1-4H3
InChIKey
OMBVUWGTKKUUTO-UHFFFAOYSA-N
Compound name
6-methoxy-1,3,9-trimethylpyrazolo[3,4-b]quinolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

257.11642 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.12370 158.2
[M+Na]+ 280.10564 174.7
[M+NH4]+ 275.15024 166.0
[M+K]+ 296.07958 169.2
[M-H]- 256.10914 159.7
[M+Na-2H]- 278.09109 163.6
[M]+ 257.11587 161.1
[M]- 257.11697 161.1
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