CID 3068397

83408-95-1

Structural Information

Molecular Formula
C23H27N3O5
SMILES
CCN(CC)C(=O)CN1C(=NC2=CC=CC=C2C1=O)C3=CC(=C(C(=C3)OC)OC)OC
InChI
InChI=1S/C23H27N3O5/c1-6-25(7-2)20(27)14-26-22(24-17-11-9-8-10-16(17)23(26)28)15-12-18(29-3)21(31-5)19(13-15)30-4/h8-13H,6-7,14H2,1-5H3
InChIKey
KICVKQDHIDLOER-UHFFFAOYSA-N
Compound name
N,N-diethyl-2-[4-oxo-2-(3,4,5-trimethoxyphenyl)quinazolin-3-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

425.19507 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 426.20235 203.4
[M+Na]+ 448.18429 211.3
[M-H]- 424.18779 210.0
[M+NH4]+ 443.22889 212.2
[M+K]+ 464.15823 208.7
[M+H-H2O]+ 408.19233 192.0
[M+HCOO]- 470.19327 223.2
[M+CH3COO]- 484.20892 236.5
[M+Na-2H]- 446.16974 204.5
[M]+ 425.19452 212.9
[M]- 425.19562 212.9
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.