CID 218528
Urea, 1-(4-heptyl)-3-phenyl-
Structural Information
- Molecular Formula
- C14H22N2O
- SMILES
- CCCC(CCC)NC(=O)NC1=CC=CC=C1
- InChI
- InChI=1S/C14H22N2O/c1-3-8-12(9-4-2)15-14(17)16-13-10-6-5-7-11-13/h5-7,10-12H,3-4,8-9H2,1-2H3,(H2,15,16,17)
- InChIKey
- HROYHGLRZADUTR-UHFFFAOYSA-N
- Compound name
- 1-heptan-4-yl-3-phenylurea
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 235.18050 | 158.5 |
[M+Na]+ | 257.16244 | 161.9 |
[M-H]- | 233.16594 | 161.2 |
[M+NH4]+ | 252.20704 | 175.5 |
[M+K]+ | 273.13638 | 159.5 |
[M+H-H2O]+ | 217.17048 | 151.1 |
[M+HCOO]- | 279.17142 | 181.9 |
[M+CH3COO]- | 293.18707 | 197.7 |
[M+Na-2H]- | 255.14789 | 162.0 |
[M]+ | 234.17267 | 158.0 |
[M]- | 234.17377 | 158.0 |
Literature stripe
No literature data available for this compound.