CID 63425

4(1h)-quinazolinone, 2,3-dihydro-1-(diethylaminoacetyl)-3-phenyl-, hydrochloride

Structural Information

Molecular Formula
C20H23N3O2
SMILES
CCN(CC)CC(=O)N1CN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3
InChI
InChI=1S/C20H23N3O2/c1-3-21(4-2)14-19(24)23-15-22(16-10-6-5-7-11-16)20(25)17-12-8-9-13-18(17)23/h5-13H,3-4,14-15H2,1-2H3
InChIKey
NDRVHPZPPUHBQW-UHFFFAOYSA-N
Compound name
1-[2-(diethylamino)acetyl]-3-phenyl-2H-quinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.17902 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.18630 182.2
[M+Na]+ 360.16824 187.5
[M-H]- 336.17174 187.4
[M+NH4]+ 355.21284 193.9
[M+K]+ 376.14218 183.3
[M+H-H2O]+ 320.17628 171.4
[M+HCOO]- 382.17722 199.8
[M+CH3COO]- 396.19287 218.1
[M+Na-2H]- 358.15369 184.7
[M]+ 337.17847 182.5
[M]- 337.17957 182.5
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.