CID 63725

Hpt 836

Structural Information

Molecular Formula
C20H25N3O
SMILES
CCN(CC)CCN1C(NC(=O)C2=CC=CC=C21)C3=CC=CC=C3
InChI
InChI=1S/C20H25N3O/c1-3-22(4-2)14-15-23-18-13-9-8-12-17(18)20(24)21-19(23)16-10-6-5-7-11-16/h5-13,19H,3-4,14-15H2,1-2H3,(H,21,24)
InChIKey
ANMNNWXCRWQTHZ-UHFFFAOYSA-N
Compound name
1-[2-(diethylamino)ethyl]-2-phenyl-2,3-dihydroquinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

323.19977 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.207046 180.2
[M+Na]+ 346.188988 185.2
[M-H]- 322.192494 183.9
[M+NH4]+ 341.233593 192.0
[M+K]+ 362.162928 179.6
[M+H-H2O]+ 306.197030 169.7
[M+HCOO]- 368.197971 197.0
[M+CH3COO]- 382.213621 214.1
[M+Na-2H]- 344.174436 183.4
[M]+ 323.19922142 178.6
[M]- 323.20031858 178.6
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.