CID 45483
63937-49-5
Structural Information
- Molecular Formula
- C20H23Cl2NO2
- SMILES
- CN1CCC2=CC(=C(C=C2C1CCC3=C(C(=CC=C3)Cl)Cl)OC)OC
- InChI
- InChI=1S/C20H23Cl2NO2/c1-23-10-9-14-11-18(24-2)19(25-3)12-15(14)17(23)8-7-13-5-4-6-16(21)20(13)22/h4-6,11-12,17H,7-10H2,1-3H3
- InChIKey
- VGQBGHMODQMJEJ-UHFFFAOYSA-N
- Compound name
- 1-[2-(2,3-dichlorophenyl)ethyl]-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinoline
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 380.11788 | 188.2 |
[M+Na]+ | 402.09982 | 197.9 |
[M-H]- | 378.10332 | 193.4 |
[M+NH4]+ | 397.14442 | 202.0 |
[M+K]+ | 418.07376 | 191.0 |
[M+H-H2O]+ | 362.10786 | 180.3 |
[M+HCOO]- | 424.10880 | 196.7 |
[M+CH3COO]- | 438.12445 | 219.5 |
[M+Na-2H]- | 400.08527 | 188.5 |
[M]+ | 379.11005 | 194.3 |
[M]- | 379.11115 | 194.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.