CID 44118317

2-(tributylstannyl)-5-(trifluoromethyl)pyridine

Structural Information

Molecular Formula
C18H30F3NSn
SMILES
CCCC[Sn](CCCC)(CCCC)C1=NC=C(C=C1)C(F)(F)F
InChI
InChI=1S/C6H3F3N.3C4H9.Sn/c7-6(8,9)5-2-1-3-10-4-5;3*1-3-4-2;/h1-2,4H;3*1,3-4H2,2H3;
InChIKey
QPRVUMOOSDCPRY-UHFFFAOYSA-N
Compound name
tributyl-[5-(trifluoromethyl)-2-pyridinyl]stannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

437.13522 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 438.142496 204.6
[M+Na]+ 460.124438 208.9
[M-H]- 436.127944 200.7
[M+NH4]+ 455.169043 216.4
[M+K]+ 476.098378 203.3
[M+H-H2O]+ 420.132480 193.3
[M+HCOO]- 482.133421 216.8
[M+CH3COO]- 496.149071 217.7
[M+Na-2H]- 458.109886 204.0
[M]+ 437.13467142 204.3
[M]- 437.13576858 204.3
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