CID 3087352
4-methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride
Structural Information
- Molecular Formula
- C22H28N2O3
- SMILES
- CCOC1=CC=CC=C1C(=O)OC(CN2CCN(CC2)C)C3=CC=CC=C3
- InChI
- InChI=1S/C22H28N2O3/c1-3-26-20-12-8-7-11-19(20)22(25)27-21(18-9-5-4-6-10-18)17-24-15-13-23(2)14-16-24/h4-12,21H,3,13-17H2,1-2H3
- InChIKey
- FZGLNPLMRPWVAX-UHFFFAOYSA-N
- Compound name
- [2-(4-methylpiperazin-1-yl)-1-phenylethyl] 2-ethoxybenzoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 369.21728 | 191.2 |
[M+Na]+ | 391.19922 | 193.5 |
[M-H]- | 367.20272 | 196.3 |
[M+NH4]+ | 386.24382 | 199.4 |
[M+K]+ | 407.17316 | 189.6 |
[M+H-H2O]+ | 351.20726 | 179.4 |
[M+HCOO]- | 413.20820 | 205.7 |
[M+CH3COO]- | 427.22385 | 216.8 |
[M+Na-2H]- | 389.18467 | 190.7 |
[M]+ | 368.20945 | 189.8 |
[M]- | 368.21055 | 189.8 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.