CID 3057646
74101-74-9
Structural Information
- Molecular Formula
- C29H31N3O4
- SMILES
- CC1=C(C=C(C=C1)CN(CCC2=CC(=C(C=C2)OC)OC)C(=O)C)N3C(=NC4=CC=CC=C4C3=O)C
- InChI
- InChI=1S/C29H31N3O4/c1-19-10-11-23(16-26(19)32-20(2)30-25-9-7-6-8-24(25)29(32)34)18-31(21(3)33)15-14-22-12-13-27(35-4)28(17-22)36-5/h6-13,16-17H,14-15,18H2,1-5H3
- InChIKey
- HHUYYXXBPZAWHR-UHFFFAOYSA-N
- Compound name
- N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[[4-methyl-3-(2-methyl-4-oxoquinazolin-3-yl)phenyl]methyl]acetamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 486.23873 | 223.7 |
[M+Na]+ | 508.22067 | 230.9 |
[M-H]- | 484.22417 | 232.9 |
[M+NH4]+ | 503.26527 | 229.4 |
[M+K]+ | 524.19461 | 226.0 |
[M+H-H2O]+ | 468.22871 | 210.2 |
[M+HCOO]- | 530.22965 | 242.0 |
[M+CH3COO]- | 544.24530 | 249.0 |
[M+Na-2H]- | 506.20612 | 222.9 |
[M]+ | 485.23090 | 231.1 |
[M]- | 485.23200 | 231.1 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.