CID 6447723
1-(2-tert-butylcrotonoyl)urea
Structural Information
- Molecular Formula
- C9H16N2O2
- SMILES
- C/C=C(/C(=O)NC(=O)N)\C(C)(C)C
- InChI
- InChI=1S/C9H16N2O2/c1-5-6(9(2,3)4)7(12)11-8(10)13/h5H,1-4H3,(H3,10,11,12,13)/b6-5-
- InChIKey
- PINGGAYTIFWXIY-WAYWQWQTSA-N
- Compound name
- (E)-2-tert-butyl-N-carbamoylbut-2-enamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 185.12847 | 144.3 |
[M+Na]+ | 207.11041 | 150.3 |
[M+NH4]+ | 202.15501 | 149.5 |
[M+K]+ | 223.08435 | 148.2 |
[M-H]- | 183.11391 | 142.0 |
[M+Na-2H]- | 205.09586 | 145.0 |
[M]+ | 184.12064 | 143.9 |
[M]- | 184.12174 | 143.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.