CID 3056996
N-butyltin tris(dibutyldithiocarbamate)
Structural Information
- Molecular Formula
- C31H63N3S6Sn
- SMILES
- CCCCN(CCCC)C(=S)S[Sn](CCCC)(SC(=S)N(CCCC)CCCC)SC(=S)N(CCCC)CCCC
- InChI
- InChI=1S/3C9H19NS2.C4H9.Sn/c3*1-3-5-7-10(9(11)12)8-6-4-2;1-3-4-2;/h3*3-8H2,1-2H3,(H,11,12);1,3-4H2,2H3;/q;;;;+3/p-3
- InChIKey
- MHUWNEDAGJMHEM-UHFFFAOYSA-K
- Compound name
- [butyl-bis(dibutylcarbamothioylsulfanyl)stannyl] N,N-dibutylcarbamodithioate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 790.24408 | 273.4 |
[M+Na]+ | 812.22602 | 265.0 |
[M-H]- | 788.22952 | 264.3 |
[M+NH4]+ | 807.27062 | 298.0 |
[M+K]+ | 828.19996 | 248.2 |
[M+H-H2O]+ | 772.23406 | 259.5 |
[M+HCOO]- | 834.23500 | 286.8 |
[M+CH3COO]- | 848.25065 | 279.3 |
[M+Na-2H]- | 810.21147 | 267.5 |
[M]+ | 789.23625 | 268.7 |
[M]- | 789.23735 | 268.7 |
Literature stripe
No literature data available for this compound.