CID 71353375

5,5''-bis(trimethylstannyl)-2,2':5',2''-terthiophene

Structural Information

Molecular Formula
C18H24S3Sn2
SMILES
C[Sn](C)(C)C1=CC=C(S1)C2=CC=C(S2)C3=CC=C(S3)[Sn](C)(C)C
InChI
InChI=1S/C12H6S3.6CH3.2Sn/c1-3-9(13-7-1)11-5-6-12(15-11)10-4-2-8-14-10;;;;;;;;/h1-6H;6*1H3;;
InChIKey
FIKQPMKITUNTEK-UHFFFAOYSA-N
Compound name
trimethyl-[5-[5-(5-trimethylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]stannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

575.90845 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 576.91573 227.5
[M+Na]+ 598.89767 237.9
[M-H]- 574.90117 237.1
[M+NH4]+ 593.94227 245.6
[M+K]+ 614.87161 230.9
[M+H-H2O]+ 558.90571 222.1
[M+HCOO]- 620.90665 234.8
[M+CH3COO]- 634.92230 220.4
[M+Na-2H]- 596.88312 219.1
[M]+ 575.90790 234.2
[M]- 575.90900 234.2
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

patents stripe