CID 6894875
2-furaldehyde n-phenylsemicarbazone
Structural Information
- Molecular Formula
- C12H11N3O2
- SMILES
- C1=CC=C(C=C1)NC(=O)N/N=C/C2=CC=CO2
- InChI
- InChI=1S/C12H11N3O2/c16-12(14-10-5-2-1-3-6-10)15-13-9-11-7-4-8-17-11/h1-9H,(H2,14,15,16)/b13-9+
- InChIKey
- YRIUZBFPCBYSBJ-UKTHLTGXSA-N
- Compound name
- 1-[(E)-furan-2-ylmethylideneamino]-3-phenylurea
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 230.09241 | 149.2 |
[M+Na]+ | 252.07435 | 154.8 |
[M-H]- | 228.07785 | 157.9 |
[M+NH4]+ | 247.11895 | 166.8 |
[M+K]+ | 268.04829 | 153.6 |
[M+H-H2O]+ | 212.08239 | 141.0 |
[M+HCOO]- | 274.08333 | 178.5 |
[M+CH3COO]- | 288.09898 | 194.7 |
[M+Na-2H]- | 250.05980 | 157.1 |
[M]+ | 229.08458 | 149.2 |
[M]- | 229.08568 | 149.2 |
Literature stripe
Patent stripe
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