CID 24208922
853312-17-1
Structural Information
- Molecular Formula
- C21H19N3O2
- SMILES
- CCOC1=CC=CC=C1C2=CC=C(O2)C3C(=C(NC(=C3C#N)C)C)C#N
- InChI
- InChI=1S/C21H19N3O2/c1-4-25-18-8-6-5-7-15(18)19-9-10-20(26-19)21-16(11-22)13(2)24-14(3)17(21)12-23/h5-10,21,24H,4H2,1-3H3
- InChIKey
- SMJFBFUQNNYGIE-UHFFFAOYSA-N
- Compound name
- 4-[5-(2-ethoxyphenyl)furan-2-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarbonitrile
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 346.15502 | 185.1 |
[M+Na]+ | 368.13696 | 196.0 |
[M-H]- | 344.14046 | 189.2 |
[M+NH4]+ | 363.18156 | 192.6 |
[M+K]+ | 384.11090 | 188.7 |
[M+H-H2O]+ | 328.14500 | 167.5 |
[M+HCOO]- | 390.14594 | 194.5 |
[M+CH3COO]- | 404.16159 | 190.6 |
[M+Na-2H]- | 366.12241 | 182.5 |
[M]+ | 345.14719 | 177.9 |
[M]- | 345.14829 | 177.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.