CID 16427123

3,5-difluoro-4-(tributylstannyl)pyridine

Structural Information

Molecular Formula
C17H29F2NSn
SMILES
CCCC[Sn](CCCC)(CCCC)C1=C(C=NC=C1F)F
InChI
InChI=1S/C5H2F2N.3C4H9.Sn/c6-4-1-5(7)3-8-2-4;3*1-3-4-2;/h2-3H;3*1,3-4H2,2H3;
InChIKey
ITBMRVUPEVXILF-UHFFFAOYSA-N
Compound name
tributyl-(3,5-difluoropyridin-4-yl)stannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

71
Patents

405.129 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 406.13628 196.3
[M+Na]+ 428.11822 201.4
[M-H]- 404.12172 194.0
[M+NH4]+ 423.16282 209.7
[M+K]+ 444.09216 196.1
[M+H-H2O]+ 388.12626 185.8
[M+HCOO]- 450.12720 211.5
[M+CH3COO]- 464.14285 213.3
[M+Na-2H]- 426.10367 195.4
[M]+ 405.12845 197.9
[M]- 405.12955 197.9
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