CID 484118

1,2-dihydro-2-(4-methoxyphenyl)-4(3h)-quinazolinone

Structural Information

Molecular Formula
C15H14N2O2
SMILES
COC1=CC=C(C=C1)C2NC3=CC=CC=C3C(=O)N2
InChI
InChI=1S/C15H14N2O2/c1-19-11-8-6-10(7-9-11)14-16-13-5-3-2-4-12(13)15(18)17-14/h2-9,14,16H,1H3,(H,17,18)
InChIKey
YYTAMNASXHFOKH-UHFFFAOYSA-N
Compound name
2-(4-methoxyphenyl)-2,3-dihydro-1H-quinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

14
References

7
Patents

254.10553 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.11281 157.9
[M+Na]+ 277.09475 165.6
[M-H]- 253.09825 160.0
[M+NH4]+ 272.13935 171.7
[M+K]+ 293.06869 159.4
[M+H-H2O]+ 237.10279 149.2
[M+HCOO]- 299.10373 173.7
[M+CH3COO]- 313.11938 168.2
[M+Na-2H]- 275.08020 163.6
[M]+ 254.10498 153.9
[M]- 254.10608 153.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe