CID 5274245
3-(2-hydroxyethoxymethyl)-6-(4-pentylphenyl)furo[2,3-d]pyrimidin-2-one
Structural Information
- Molecular Formula
- C20H24N2O4
- SMILES
- CCCCCC1=CC=C(C=C1)C2=CC3=CN(C(=O)N=C3O2)COCCO
- InChI
- InChI=1S/C20H24N2O4/c1-2-3-4-5-15-6-8-16(9-7-15)18-12-17-13-22(14-25-11-10-23)20(24)21-19(17)26-18/h6-9,12-13,23H,2-5,10-11,14H2,1H3
- InChIKey
- BHBQQFNTZBPTNP-UHFFFAOYSA-N
- Compound name
- 3-(2-hydroxyethoxymethyl)-6-(4-pentylphenyl)furo[2,3-d]pyrimidin-2-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 357.18088 | 185.2 |
[M+Na]+ | 379.16282 | 194.5 |
[M-H]- | 355.16632 | 190.0 |
[M+NH4]+ | 374.20742 | 196.5 |
[M+K]+ | 395.13676 | 190.1 |
[M+H-H2O]+ | 339.17086 | 175.8 |
[M+HCOO]- | 401.17180 | 205.2 |
[M+CH3COO]- | 415.18745 | 212.3 |
[M+Na-2H]- | 377.14827 | 188.5 |
[M]+ | 356.17305 | 193.5 |
[M]- | 356.17415 | 193.5 |
Literature stripe
Patent stripe
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