CID 484122

2-(3,4-dimethoxyphenyl)-2,3-dihydroquinazolin-4(1h)-one

Structural Information

Molecular Formula
C16H16N2O3
SMILES
COC1=C(C=C(C=C1)C2NC3=CC=CC=C3C(=O)N2)OC
InChI
InChI=1S/C16H16N2O3/c1-20-13-8-7-10(9-14(13)21-2)15-17-12-6-4-3-5-11(12)16(19)18-15/h3-9,15,17H,1-2H3,(H,18,19)
InChIKey
YZIVOOSZLQIMSY-UHFFFAOYSA-N
Compound name
2-(3,4-dimethoxyphenyl)-2,3-dihydro-1H-quinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

5
Patents

284.1161 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.12338 165.8
[M+Na]+ 307.10532 173.7
[M-H]- 283.10882 168.1
[M+NH4]+ 302.14992 178.5
[M+K]+ 323.07926 168.1
[M+H-H2O]+ 267.11336 156.8
[M+HCOO]- 329.11430 181.4
[M+CH3COO]- 343.12995 175.8
[M+Na-2H]- 305.09077 170.3
[M]+ 284.11555 163.9
[M]- 284.11665 163.9
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.