CID 28829
17901-74-5
Structural Information
- Molecular Formula
- C20H28N2
- SMILES
- C1CCC2=C(CC1)N(C3=CC=CC=C23)CCN4CCCCC4
- InChI
- InChI=1S/C20H28N2/c1-3-9-17-18-10-5-6-12-20(18)22(19(17)11-4-1)16-15-21-13-7-2-8-14-21/h5-6,10,12H,1-4,7-9,11,13-16H2
- InChIKey
- VXNCGZASURMYOI-UHFFFAOYSA-N
- Compound name
- 5-(2-piperidin-1-ylethyl)-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 297.23253 | 172.9 |
[M+Na]+ | 319.21447 | 176.7 |
[M-H]- | 295.21797 | 178.2 |
[M+NH4]+ | 314.25907 | 187.9 |
[M+K]+ | 335.18841 | 173.3 |
[M+H-H2O]+ | 279.22251 | 163.8 |
[M+HCOO]- | 341.22345 | 186.9 |
[M+CH3COO]- | 355.23910 | 181.6 |
[M+Na-2H]- | 317.19992 | 174.4 |
[M]+ | 296.22470 | 165.4 |
[M]- | 296.22580 | 165.4 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.