CID 135512367

2-methylpyrazolo[1,5-a]quinazolin-5(4h)-one

Structural Information

Molecular Formula
C11H9N3O
SMILES
CC1=NN2C3=CC=CC=C3C(=O)NC2=C1
InChI
InChI=1S/C11H9N3O/c1-7-6-10-12-11(15)8-4-2-3-5-9(8)14(10)13-7/h2-6H,1H3,(H,12,15)
InChIKey
RFGCWJZOFBNOEK-UHFFFAOYSA-N
Compound name
2-methyl-4H-pyrazolo[1,5-a]quinazolin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

8
Patents

199.07455 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.08183 140.7
[M+Na]+ 222.06377 153.8
[M-H]- 198.06727 142.2
[M+NH4]+ 217.10837 159.8
[M+K]+ 238.03771 148.2
[M+H-H2O]+ 182.07181 133.2
[M+HCOO]- 244.07275 161.4
[M+CH3COO]- 258.08840 154.3
[M+Na-2H]- 220.04922 149.4
[M]+ 199.07400 142.7
[M]- 199.07510 142.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe