CID 2913480
371924-49-1
Structural Information
- Molecular Formula
- C22H17FN2O4
- SMILES
- CC1=CC=C(O1)C(=O)C2=C(C(=O)N(C2C3=CC=C(C=C3)F)CC4=CN=CC=C4)O
- InChI
- InChI=1S/C22H17FN2O4/c1-13-4-9-17(29-13)20(26)18-19(15-5-7-16(23)8-6-15)25(22(28)21(18)27)12-14-3-2-10-24-11-14/h2-11,19,27H,12H2,1H3
- InChIKey
- XSRKCTJRXUFBJY-UHFFFAOYSA-N
- Compound name
- 2-(4-fluorophenyl)-4-hydroxy-3-(5-methylfuran-2-carbonyl)-1-(pyridin-3-ylmethyl)-2H-pyrrol-5-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 393.12453 | 190.3 |
[M+Na]+ | 415.10647 | 199.4 |
[M-H]- | 391.10997 | 200.3 |
[M+NH4]+ | 410.15107 | 200.2 |
[M+K]+ | 431.08041 | 194.7 |
[M+H-H2O]+ | 375.11451 | 180.5 |
[M+HCOO]- | 437.11545 | 208.7 |
[M+CH3COO]- | 451.13110 | 200.7 |
[M+Na-2H]- | 413.09192 | 186.4 |
[M]+ | 392.11670 | 192.1 |
[M]- | 392.11780 | 192.1 |