CID 4557394
N-(cyclohexylmethyl)-n'-phenylurea
Structural Information
- Molecular Formula
- C14H20N2O
- SMILES
- C1CCC(CC1)CNC(=O)NC2=CC=CC=C2
- InChI
- InChI=1S/C14H20N2O/c17-14(16-13-9-5-2-6-10-13)15-11-12-7-3-1-4-8-12/h2,5-6,9-10,12H,1,3-4,7-8,11H2,(H2,15,16,17)
- InChIKey
- RNPNQEFRIDREDZ-UHFFFAOYSA-N
- Compound name
- 1-(cyclohexylmethyl)-3-phenylurea
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 233.16484 | 153.7 |
[M+Na]+ | 255.14678 | 155.6 |
[M-H]- | 231.15028 | 158.9 |
[M+NH4]+ | 250.19138 | 170.2 |
[M+K]+ | 271.12072 | 152.7 |
[M+H-H2O]+ | 215.15482 | 145.7 |
[M+HCOO]- | 277.15576 | 175.3 |
[M+CH3COO]- | 291.17141 | 193.6 |
[M+Na-2H]- | 253.13223 | 158.4 |
[M]+ | 232.15701 | 147.0 |
[M]- | 232.15811 | 147.0 |