CID 70240
929-41-9
Structural Information
- Molecular Formula
- C15H33NO3S2
- SMILES
- CCCCCCCCCCCCCNCCSS(=O)(=O)O
- InChI
- InChI=1S/C15H33NO3S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-14-15-20-21(17,18)19/h16H,2-15H2,1H3,(H,17,18,19)
- InChIKey
- MDCFFJPIOHVMNO-UHFFFAOYSA-N
- Compound name
- 1-(2-sulfosulfanylethylamino)tridecane
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 340.19748 | 180.7 |
[M+Na]+ | 362.17942 | 182.7 |
[M-H]- | 338.18292 | 177.1 |
[M+NH4]+ | 357.22402 | 193.6 |
[M+K]+ | 378.15336 | 176.6 |
[M+H-H2O]+ | 322.18746 | 173.4 |
[M+HCOO]- | 384.18840 | 189.1 |
[M+CH3COO]- | 398.20405 | 209.2 |
[M+Na-2H]- | 360.16487 | 178.9 |
[M]+ | 339.18965 | 187.2 |
[M]- | 339.19075 | 187.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.