CID 3070704
2-propanol, 1-(dimethylamino)-3-(2-(2-(4-(dimethylamino)phenyl)ethyl)phenoxy)-, dihydrochloride
Structural Information
- Molecular Formula
- C21H30N2O2
- SMILES
- CN(C)CC(COC1=CC=CC=C1CCC2=CC=C(C=C2)N(C)C)O
- InChI
- InChI=1S/C21H30N2O2/c1-22(2)15-20(24)16-25-21-8-6-5-7-18(21)12-9-17-10-13-19(14-11-17)23(3)4/h5-8,10-11,13-14,20,24H,9,12,15-16H2,1-4H3
- InChIKey
- BATAHTIDJATXQM-UHFFFAOYSA-N
- Compound name
- 1-(dimethylamino)-3-[2-[2-[4-(dimethylamino)phenyl]ethyl]phenoxy]propan-2-ol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 343.23802 | 187.2 |
[M+Na]+ | 365.21996 | 190.1 |
[M-H]- | 341.22346 | 194.3 |
[M+NH4]+ | 360.26456 | 200.3 |
[M+K]+ | 381.19390 | 188.3 |
[M+H-H2O]+ | 325.22800 | 177.6 |
[M+HCOO]- | 387.22894 | 210.0 |
[M+CH3COO]- | 401.24459 | 224.3 |
[M+Na-2H]- | 363.20541 | 187.5 |
[M]+ | 342.23019 | 190.8 |
[M]- | 342.23129 | 190.8 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.