CID 59534386
Lazucirnon
Structural Information
- Molecular Formula
- C27H34ClN5O3
- SMILES
- CC1=CC(=CC(=N1)NC(=O)[C@H]2CCC(=O)N2C3CCN(CC3)CC4=CC(=C(C=C4)Cl)C)C(=O)N(C)C
- InChI
- InChI=1S/C27H34ClN5O3/c1-17-13-19(5-6-22(17)28)16-32-11-9-21(10-12-32)33-23(7-8-25(33)34)26(35)30-24-15-20(14-18(2)29-24)27(36)31(3)4/h5-6,13-15,21,23H,7-12,16H2,1-4H3,(H,29,30,35)/t23-/m1/s1
- InChIKey
- DWKNOLCXIFYNFV-HSZRJFAPSA-N
- Compound name
- 2-[[(2R)-1-[1-[(4-chloro-3-methylphenyl)methyl]piperidin-4-yl]-5-oxopyrrolidine-2-carbonyl]amino]-N,N,6-trimethylpyridine-4-carboxamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 512.24230 | 226.3 |
[M+Na]+ | 534.22424 | 229.5 |
[M-H]- | 510.22774 | 235.6 |
[M+NH4]+ | 529.26884 | 230.7 |
[M+K]+ | 550.19818 | 223.9 |
[M+H-H2O]+ | 494.23228 | 214.2 |
[M+HCOO]- | 556.23322 | 235.4 |
[M+CH3COO]- | 570.24887 | 251.8 |
[M+Na-2H]- | 532.20969 | 218.1 |
[M]+ | 511.23447 | 225.8 |
[M]- | 511.23557 | 225.8 |