CID 9569949

Nsc628594

Structural Information

Molecular Formula
C22H18N2S2Sn
SMILES
C=C[Sn](C=C)(SC1=CC=CC2=C1N=CC=C2)SC3=CC=CC4=C3N=CC=C4
InChI
InChI=1S/2C9H7NS.2C2H3.Sn/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;2*1-2;/h2*1-6,11H;2*1H,2H2;/q;;;;+2/p-2
InChIKey
MCSOMHUOVIBKIY-UHFFFAOYSA-L
Compound name
bis(ethenyl)-bis(quinolin-8-ylsulfanyl)stannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

493.99335 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 495.00063 207.8
[M+Na]+ 516.98257 217.0
[M-H]- 492.98607 211.8
[M+NH4]+ 512.02717 218.3
[M+K]+ 532.95651 206.2
[M+H-H2O]+ 476.99061 197.9
[M+HCOO]- 538.99155 215.2
[M+CH3COO]- 553.00720 215.3
[M+Na-2H]- 514.96802 211.9
[M]+ 493.99280 211.4
[M]- 493.99390 211.4
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.