CID 9573250

Nsc118038

Structural Information

Molecular Formula
C22H30N2S4Sn
SMILES
CCN(CC)C(=S)S[Sn](C1=CC=CC=C1)(C2=CC=CC=C2)SC(=S)N(CC)CC
InChI
InChI=1S/2C6H5.2C5H11NS2.Sn/c2*1-2-4-6-5-3-1;2*1-3-6(4-2)5(7)8;/h2*1-5H;2*3-4H2,1-2H3,(H,7,8);/q;;;;+2/p-2
InChIKey
PBCDRACXNVNRRQ-UHFFFAOYSA-L
Compound name
[diethylcarbamothioylsulfanyl(diphenyl)stannyl] N,N-diethylcarbamodithioate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

570.0314 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 571.03868 224.8
[M+Na]+ 593.02062 225.6
[M-H]- 569.02412 227.7
[M+NH4]+ 588.06522 232.2
[M+K]+ 608.99456 215.0
[M+H-H2O]+ 553.02866 214.2
[M+HCOO]- 615.02960 221.5
[M+CH3COO]- 629.04525 241.6
[M+Na-2H]- 591.00607 222.0
[M]+ 570.03085 224.2
[M]- 570.03195 224.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.