CID 6446540
Brn 0410846
Structural Information
- Molecular Formula
- C18H16N2O
- SMILES
- C/C(=C/C(=O)C1=C(NC2=CC=CC=C21)C3=CC=CC=C3)/N
- InChI
- InChI=1S/C18H16N2O/c1-12(19)11-16(21)17-14-9-5-6-10-15(14)20-18(17)13-7-3-2-4-8-13/h2-11,20H,19H2,1H3/b12-11-
- InChIKey
- UIOXYFATQNTMAT-QXMHVHEDSA-N
- Compound name
- (Z)-3-amino-1-(2-phenyl-1H-indol-3-yl)but-2-en-1-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 277.13353 | 165.3 |
[M+Na]+ | 299.11547 | 178.5 |
[M+NH4]+ | 294.16007 | 173.1 |
[M+K]+ | 315.08941 | 173.0 |
[M-H]- | 275.11897 | 169.1 |
[M+Na-2H]- | 297.10092 | 172.7 |
[M]+ | 276.12570 | 168.1 |
[M]- | 276.12680 | 168.1 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.