CID 3061892
(-)-6,7,8,9-tetrahydro-2,12-dimethoxy-7-methyl-5h-dibenz(d,f)azonin-1-ol hydrochloride
Structural Information
- Molecular Formula
- C26H28FNO3
- SMILES
- CN1CCC2=C(C=C(C=C2)OC)C3=C(CC1CC4=CC=C(C=C4)F)C=CC(=C3O)OC
- InChI
- InChI=1S/C26H28FNO3/c1-28-13-12-18-6-10-22(30-2)16-23(18)25-19(7-11-24(31-3)26(25)29)15-21(28)14-17-4-8-20(27)9-5-17/h4-11,16,21,29H,12-15H2,1-3H3
- InChIKey
- LJNIUCBMBSOCQJ-UHFFFAOYSA-N
- Compound name
- 9-[(4-fluorophenyl)methyl]-4,16-dimethoxy-10-methyl-10-azatricyclo[11.4.0.02,7]heptadeca-1(13),2(7),3,5,14,16-hexaen-3-ol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 422.21260 | 208.9 |
[M+Na]+ | 444.19454 | 204.2 |
[M-H]- | 420.19804 | 206.1 |
[M+NH4]+ | 439.23914 | 206.3 |
[M+K]+ | 460.16848 | 204.6 |
[M+H-H2O]+ | 404.20258 | 197.4 |
[M+HCOO]- | 466.20352 | 206.7 |
[M+CH3COO]- | 480.21917 | 207.0 |
[M+Na-2H]- | 442.17999 | 207.4 |
[M]+ | 421.20477 | 206.3 |
[M]- | 421.20587 | 206.3 |
Literature stripe
No literature data available for this compound.