CID 3856728
2-(piperazin-1-ylmethyl)-1,3-benzothiazole dihydrochloride
Structural Information
- Molecular Formula
- C12H15N3S
- SMILES
- C1CN(CCN1)CC2=NC3=CC=CC=C3S2
- InChI
- InChI=1S/C12H15N3S/c1-2-4-11-10(3-1)14-12(16-11)9-15-7-5-13-6-8-15/h1-4,13H,5-9H2
- InChIKey
- DMMLNYGSUHAMCP-UHFFFAOYSA-N
- Compound name
- 2-(piperazin-1-ylmethyl)-1,3-benzothiazole
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 234.10594 | 149.6 |
[M+Na]+ | 256.08788 | 162.9 |
[M+NH4]+ | 251.13248 | 159.0 |
[M+K]+ | 272.06182 | 154.9 |
[M-H]- | 232.09138 | 152.8 |
[M+Na-2H]- | 254.07333 | 156.6 |
[M]+ | 233.09811 | 152.8 |
[M]- | 233.09921 | 152.8 |
Literature stripe
No literature data available for this compound.