CID 199309
3-chloro-10-(3-(4-p-chlorophenyl-4-hydroxypiperidino)propyl)phenothiazine hydrochloride
Structural Information
- Molecular Formula
- C26H26Cl2N2OS
- SMILES
- C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCCN3C4=C(C=C(C=C4)Cl)SC5=CC=CC=C53
- InChI
- InChI=1S/C26H26Cl2N2OS/c27-20-8-6-19(7-9-20)26(31)12-16-29(17-13-26)14-3-15-30-22-4-1-2-5-24(22)32-25-18-21(28)10-11-23(25)30/h1-2,4-11,18,31H,3,12-17H2
- InChIKey
- VNCOSJSHZMZGCK-UHFFFAOYSA-N
- Compound name
- 1-[3-(3-chlorophenothiazin-10-yl)propyl]-4-(4-chlorophenyl)piperidin-4-ol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 485.12158 | 208.9 |
[M+Na]+ | 507.10352 | 216.2 |
[M-H]- | 483.10702 | 213.8 |
[M+NH4]+ | 502.14812 | 218.6 |
[M+K]+ | 523.07746 | 206.8 |
[M+H-H2O]+ | 467.11156 | 198.3 |
[M+HCOO]- | 529.11250 | 206.2 |
[M+CH3COO]- | 543.12815 | 214.9 |
[M+Na-2H]- | 505.08897 | 209.5 |
[M]+ | 484.11375 | 210.0 |
[M]- | 484.11485 | 210.0 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.