CID 3050371
4-(2,4-dimethoxyphenyl)-alpha-phenoxymethyl-1-piperazineethanol
Structural Information
- Molecular Formula
- C21H28N2O4
- SMILES
- COC1=CC(=C(C=C1)N2CCN(CC2)CC(COC3=CC=CC=C3)O)OC
- InChI
- InChI=1S/C21H28N2O4/c1-25-19-8-9-20(21(14-19)26-2)23-12-10-22(11-13-23)15-17(24)16-27-18-6-4-3-5-7-18/h3-9,14,17,24H,10-13,15-16H2,1-2H3
- InChIKey
- IKQGBOUZXICARC-UHFFFAOYSA-N
- Compound name
- 1-[4-(2,4-dimethoxyphenyl)piperazin-1-yl]-3-phenoxypropan-2-ol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 373.21218 | 190.7 |
[M+Na]+ | 395.19412 | 193.8 |
[M-H]- | 371.19762 | 195.0 |
[M+NH4]+ | 390.23872 | 198.4 |
[M+K]+ | 411.16806 | 190.0 |
[M+H-H2O]+ | 355.20216 | 179.2 |
[M+HCOO]- | 417.20310 | 205.1 |
[M+CH3COO]- | 431.21875 | 215.3 |
[M+Na-2H]- | 393.17957 | 190.9 |
[M]+ | 372.20435 | 190.4 |
[M]- | 372.20545 | 190.4 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.