CID 79928

5847-53-0

Structural Information

Molecular Formula

C₁₇H₃₇NS₂Sn

SMILES

CCCC[Sn](CCCC)(CCCC)SC(=S)N(CC)CC

InChI

InChI=1S/C5H11NS2.3C4H9.Sn/c1-3-6(4-2)5(7)8;3*1-3-4-2;/h3-4H2,1-2H3,(H,7,8);3*1,3-4H2,2H3;/q;;;;+1/p-1

InChIKey

XGLILJKLOLKQLC-UHFFFAOYSA-M

Compound name

tributylstannyl N,N-diethylcarbamodithioate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 439.13895 Da
Monoisotopic Mass: None
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	440.14623	204.4
[M+Na]+	462.12817	205.3
[M-H]-	438.13167	203.0
[M+NH4]+	457.17277	218.4
[M+K]+	478.10211	200.2
[M+H-H2O]+	422.13621	195.8
[M+HCOO]-	484.13715	210.8
[M+CH3COO]-	498.15280	222.2
[M+Na-2H]-	460.11362	197.4
[M]+	439.13840	211.1
[M]-	439.13950	211.1

Literature stripe

literature stripe

Patent stripe

patents stripe