CID 3049761
2,3-dihydro-2-((diphenylamino)methylene)-5-fluoro-1h-inden-1-one
Structural Information
- Molecular Formula
- C22H16FNO
- SMILES
- C\1C2=C(C=CC(=C2)F)C(=O)/C1=C/N(C3=CC=CC=C3)C4=CC=CC=C4
- InChI
- InChI=1S/C22H16FNO/c23-18-11-12-21-16(14-18)13-17(22(21)25)15-24(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-12,14-15H,13H2/b17-15+
- InChIKey
- GFCODUWSHBNHPA-BMRADRMJSA-N
- Compound name
- (2E)-5-fluoro-2-[(N-phenylanilino)methylidene]-3H-inden-1-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 330.12886 | 177.3 |
[M+Na]+ | 352.11080 | 184.7 |
[M-H]- | 328.11430 | 187.9 |
[M+NH4]+ | 347.15540 | 193.7 |
[M+K]+ | 368.08474 | 178.1 |
[M+H-H2O]+ | 312.11884 | 167.3 |
[M+HCOO]- | 374.11978 | 200.4 |
[M+CH3COO]- | 388.13543 | 188.7 |
[M+Na-2H]- | 350.09625 | 179.4 |
[M]+ | 329.12103 | 175.1 |
[M]- | 329.12213 | 175.1 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.