CID 123442

33376-05-5

Structural Information

Molecular Formula
C10H11N3
SMILES
C1CN2CC3=CC=CC=C3NC2=N1
InChI
InChI=1S/C10H11N3/c1-2-4-9-8(3-1)7-13-6-5-11-10(13)12-9/h1-4H,5-7H2,(H,11,12)
InChIKey
DLLZYXWYSUGNDI-UHFFFAOYSA-N
Compound name
2,3,5,10-tetrahydroimidazo[2,1-b]quinazoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

23
Patents

173.09529 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.10257 136.2
[M+Na]+ 196.08451 144.6
[M-H]- 172.08801 135.9
[M+NH4]+ 191.12911 155.5
[M+K]+ 212.05845 140.1
[M+H-H2O]+ 156.09255 128.2
[M+HCOO]- 218.09349 152.7
[M+CH3COO]- 232.10914 148.1
[M+Na-2H]- 194.06996 143.9
[M]+ 173.09474 132.1
[M]- 173.09584 132.1
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