CID 3061665

79513-73-8

Structural Information

Molecular Formula
C16H24N4O
SMILES
CCN(CC)CCN1CCCN2C1=NC3=C2C=CC(=C3)O
InChI
InChI=1S/C16H24N4O/c1-3-18(4-2)10-11-19-8-5-9-20-15-7-6-13(21)12-14(15)17-16(19)20/h6-7,12,21H,3-5,8-11H2,1-2H3
InChIKey
BFYRXRWUCDAYCX-UHFFFAOYSA-N
Compound name
1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazol-8-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.195 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.20228 169.7
[M+Na]+ 311.18422 177.2
[M-H]- 287.18772 170.9
[M+NH4]+ 306.22882 185.2
[M+K]+ 327.15816 172.9
[M+H-H2O]+ 271.19226 160.5
[M+HCOO]- 333.19320 187.1
[M+CH3COO]- 347.20885 179.9
[M+Na-2H]- 309.16967 173.7
[M]+ 288.19445 171.7
[M]- 288.19555 171.7
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.