CID 63159

Brn 0831597

Structural Information

Molecular Formula
C18H19N3O2
SMILES
CCOCC1=NC2=C(C=C(C=C2)N)C(=O)N1C3=CC=CC=C3C
InChI
InChI=1S/C18H19N3O2/c1-3-23-11-17-20-15-9-8-13(19)10-14(15)18(22)21(17)16-7-5-4-6-12(16)2/h4-10H,3,11,19H2,1-2H3
InChIKey
XVDOWDITJCMVSE-UHFFFAOYSA-N
Compound name
6-amino-2-(ethoxymethyl)-3-(2-methylphenyl)quinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.14774 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.15502 173.7
[M+Na]+ 332.13696 189.8
[M+NH4]+ 327.18156 181.2
[M+K]+ 348.11090 181.5
[M-H]- 308.14046 178.4
[M+Na-2H]- 330.12241 181.9
[M]+ 309.14719 177.4
[M]- 309.14829 177.4
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.