CID 12682184
4,5-dihydropiperlonguminine
Structural Information
- Molecular Formula
- C16H21NO3
- SMILES
- CC(C)CNC(=O)/C=C/CCC1=CC2=C(C=C1)OCO2
- InChI
- InChI=1S/C16H21NO3/c1-12(2)10-17-16(18)6-4-3-5-13-7-8-14-15(9-13)20-11-19-14/h4,6-9,12H,3,5,10-11H2,1-2H3,(H,17,18)/b6-4+
- InChIKey
- CSGDXLXTJVRNEA-GQCTYLIASA-N
- Compound name
- (E)-5-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)pent-2-enamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 276.15941 | 168.7 |
[M+Na]+ | 298.14135 | 173.6 |
[M-H]- | 274.14485 | 173.6 |
[M+NH4]+ | 293.18595 | 184.6 |
[M+K]+ | 314.11529 | 172.6 |
[M+H-H2O]+ | 258.14939 | 162.3 |
[M+HCOO]- | 320.15033 | 188.2 |
[M+CH3COO]- | 334.16598 | 201.3 |
[M+Na-2H]- | 296.12680 | 171.6 |
[M]+ | 275.15158 | 171.4 |
[M]- | 275.15268 | 171.4 |