CID 210762
21602-50-6
Structural Information
- Molecular Formula
- C16H26NS
- SMILES
- C[N+]1(CCCCC1)C2(CCCCC2)C3=CSC=C3
- InChI
- InChI=1S/C16H26NS/c1-17(11-6-3-7-12-17)16(9-4-2-5-10-16)15-8-13-18-14-15/h8,13-14H,2-7,9-12H2,1H3/q+1
- InChIKey
- RCEARSUGYGWRFT-UHFFFAOYSA-N
- Compound name
- 1-methyl-1-(1-thiophen-3-ylcyclohexyl)piperidin-1-ium
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 265.18588 | 162.6 |
[M+Na]+ | 287.16782 | 165.7 |
[M-H]- | 263.17132 | 169.4 |
[M+NH4]+ | 282.21242 | 183.0 |
[M+K]+ | 303.14176 | 156.6 |
[M+H-H2O]+ | 247.17586 | 157.4 |
[M+HCOO]- | 309.17680 | 173.4 |
[M+CH3COO]- | 323.19245 | 185.4 |
[M+Na-2H]- | 285.15327 | 164.7 |
[M]+ | 264.17805 | 153.9 |
[M]- | 264.17915 | 153.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.