CID 43414946
1154873-08-1
Structural Information
- Molecular Formula
- C12H13N3O2
- SMILES
- C1=COC(=C1)CNC(=O)NC2=CC=C(C=C2)N
- InChI
- InChI=1S/C12H13N3O2/c13-9-3-5-10(6-4-9)15-12(16)14-8-11-2-1-7-17-11/h1-7H,8,13H2,(H2,14,15,16)
- InChIKey
- ZYEOOUADZDVQBM-UHFFFAOYSA-N
- Compound name
- 1-(4-aminophenyl)-3-(furan-2-ylmethyl)urea
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 232.10805 | 150.5 |
[M+Na]+ | 254.08999 | 156.2 |
[M-H]- | 230.09349 | 157.6 |
[M+NH4]+ | 249.13459 | 167.4 |
[M+K]+ | 270.06393 | 154.4 |
[M+H-H2O]+ | 214.09803 | 142.7 |
[M+HCOO]- | 276.09897 | 177.4 |
[M+CH3COO]- | 290.11462 | 194.4 |
[M+Na-2H]- | 252.07544 | 156.3 |
[M]+ | 231.10022 | 148.8 |
[M]- | 231.10132 | 148.8 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.