CID 9562033

Dibutyltin diisothiocyanate

Structural Information

Molecular Formula
C10H18N2S2Sn
SMILES
CCCC[Sn](CCCC)(N=C=S)N=C=S
InChI
InChI=1S/2C4H9.2CNS.Sn/c2*1-3-4-2;2*2-1-3;/h2*1,3-4H2,2H3;;;/q;;2*-1;+2
InChIKey
JVLGWEJONYVDMO-UHFFFAOYSA-N
Compound name
dibutyl(diisothiocyanato)stannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

69
Patents

349.99335 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.00063 176.3
[M+Na]+ 372.98257 181.1
[M-H]- 348.98607 177.3
[M+NH4]+ 368.02717 193.9
[M+K]+ 388.95651 175.5
[M+H-H2O]+ 332.99061 168.1
[M+HCOO]- 394.99155 189.6
[M+CH3COO]- 409.00720 204.9
[M+Na-2H]- 370.96802 175.0
[M]+ 349.99280 180.4
[M]- 349.99390 180.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe