CID 948853
497246-02-3
Structural Information
- Molecular Formula
- C18H16N2OS
- SMILES
- CC(=C)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3
- InChI
- InChI=1S/C18H16N2OS/c1-13(2)12-22-18-19-16-11-7-6-10-15(16)17(21)20(18)14-8-4-3-5-9-14/h3-11H,1,12H2,2H3
- InChIKey
- LFNDSAZDPHWTCV-UHFFFAOYSA-N
- Compound name
- 2-(2-methylprop-2-enylsulfanyl)-3-phenylquinazolin-4-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 309.10561 | 170.0 |
[M+Na]+ | 331.08755 | 186.5 |
[M+NH4]+ | 326.13215 | 178.7 |
[M+K]+ | 347.06149 | 175.4 |
[M-H]- | 307.09105 | 174.7 |
[M+Na-2H]- | 329.07300 | 178.9 |
[M]+ | 308.09778 | 174.4 |
[M]- | 308.09888 | 174.4 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.