CID 16684076

Tributyltin oleate

Structural Information

Molecular Formula
C30H60O2Sn
SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)O[Sn](CCCC)(CCCC)CCCC
InChI
InChI=1S/C18H34O2.3C4H9.Sn/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;3*1-3-4-2;/h9-10H,2-8,11-17H2,1H3,(H,19,20);3*1,3-4H2,2H3;/q;;;;+1/p-1/b10-9-;;;;
InChIKey
VAFVPAKNJFBOFX-HKIWRJGFSA-M
Compound name
tributylstannyl (Z)-octadec-9-enoate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

178
Patents

572.3615 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 573.36878 254.0
[M+Na]+ 595.35072 261.2
[M-H]- 571.35422 239.7
[M+NH4]+ 590.39532 255.0
[M+K]+ 611.32466 261.3
[M+H-H2O]+ 555.35876 246.3
[M+HCOO]- 617.35970 264.6
[M+CH3COO]- 631.37535 247.5
[M+Na-2H]- 593.33617 238.7
[M]+ 572.36095 253.8
[M]- 572.36205 253.8
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