CID 26825
9,10-dihydro-11-(3-dimethylaminopropyl)9,10-ethanoanthracene methyliodide
Structural Information
- Molecular Formula
- C22H28N
- SMILES
- C[N+](C)(C)CCCC1CC2C3=CC=CC=C3C1C4=CC=CC=C24
- InChI
- InChI=1S/C22H28N/c1-23(2,3)14-8-9-16-15-21-17-10-4-6-12-19(17)22(16)20-13-7-5-11-18(20)21/h4-7,10-13,16,21-22H,8-9,14-15H2,1-3H3/q+1
- InChIKey
- MYSHQQDVOQRAQT-UHFFFAOYSA-N
- Compound name
- trimethyl-[3-(15-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)propyl]azanium
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 307.22945 | 174.7 |
[M+Na]+ | 329.21139 | 177.7 |
[M-H]- | 305.21489 | 177.6 |
[M+NH4]+ | 324.25599 | 194.4 |
[M+K]+ | 345.18533 | 167.4 |
[M+H-H2O]+ | 289.21943 | 168.5 |
[M+HCOO]- | 351.22037 | 186.7 |
[M+CH3COO]- | 365.23602 | 213.8 |
[M+Na-2H]- | 327.19684 | 186.0 |
[M]+ | 306.22162 | 176.2 |
[M]- | 306.22272 | 176.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.