CID 3068399

Brn 4598980

Structural Information

Molecular Formula
C24H29N3O5
SMILES
CCN(CC)C(=O)C(C)N1C(=NC2=CC=CC=C2C1=O)C3=CC(=C(C(=C3)OC)OC)OC
InChI
InChI=1S/C24H29N3O5/c1-7-26(8-2)23(28)15(3)27-22(25-18-12-10-9-11-17(18)24(27)29)16-13-19(30-4)21(32-6)20(14-16)31-5/h9-15H,7-8H2,1-6H3
InChIKey
IZEFYFMETPHBOX-UHFFFAOYSA-N
Compound name
N,N-diethyl-2-[4-oxo-2-(3,4,5-trimethoxyphenyl)quinazolin-3-yl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

439.21072 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 440.21800 207.2
[M+Na]+ 462.19994 214.3
[M-H]- 438.20344 213.7
[M+NH4]+ 457.24454 215.3
[M+K]+ 478.17388 212.1
[M+H-H2O]+ 422.20798 195.9
[M+HCOO]- 484.20892 225.6
[M+CH3COO]- 498.22457 240.3
[M+Na-2H]- 460.18539 206.7
[M]+ 439.21017 216.5
[M]- 439.21127 216.5
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.