CID 4418609
75690-75-4
Structural Information
- Molecular Formula
- C19H36N8O4
- SMILES
- CC(C)CC(C(=O)NC(CCCN=C(N)N)C(=O)N1CCCC1C(=O)NCC(=O)N)N
- InChI
- InChI=1S/C19H36N8O4/c1-11(2)9-12(20)16(29)26-13(5-3-7-24-19(22)23)18(31)27-8-4-6-14(27)17(30)25-10-15(21)28/h11-14H,3-10,20H2,1-2H3,(H2,21,28)(H,25,30)(H,26,29)(H4,22,23,24)
- InChIKey
- JQESMPDJSXFGSA-UHFFFAOYSA-N
- Compound name
- 1-[2-[(2-amino-4-methylpentanoyl)amino]-5-(diaminomethylideneamino)pentanoyl]-N-(2-amino-2-oxoethyl)pyrrolidine-2-carboxamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 441.29323 | 206.1 |
[M+Na]+ | 463.27517 | 201.7 |
[M-H]- | 439.27867 | 206.5 |
[M+NH4]+ | 458.31977 | 212.4 |
[M+K]+ | 479.24911 | 204.0 |
[M+H-H2O]+ | 423.28321 | 195.8 |
[M+HCOO]- | 485.28415 | 224.0 |
[M+CH3COO]- | 499.29980 | 252.4 |
[M+Na-2H]- | 461.26062 | 196.2 |
[M]+ | 440.28540 | 197.9 |
[M]- | 440.28650 | 197.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.