CID 44148696

Einecs 304-757-0

Structural Information

Molecular Formula
C52H106O5Sn2
SMILES
CCCC[Sn](CCCC)(OC(=O)CCCCCCCCCCCCCCC(C)C)O[Sn](CCCC)(CCCC)OC(=O)CCCCCCCCCCCCCCC(C)C
InChI
InChI=1S/2C18H36O2.4C4H9.O.2Sn/c2*1-17(2)15-13-11-9-7-5-3-4-6-8-10-12-14-16-18(19)20;4*1-3-4-2;;;/h2*17H,3-16H2,1-2H3,(H,19,20);4*1,3-4H2,2H3;;;/q;;;;;;;2*+1/p-2
InChIKey
LECUKTRGNBSAHL-UHFFFAOYSA-L
Compound name
[dibutyl-[dibutyl(16-methylheptadecanoyloxy)stannyl]oxystannyl] 16-methylheptadecanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

1050.6084 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 1051.6157 315.7
[M+Na]+ 1073.5976 315.0
[M+NH4]+ 1068.6422 319.5
[M+K]+ 1089.5716 317.5
[M-H]- 1049.6011 297.3
[M+Na-2H]- 1071.5831 309.7
[M]+ 1050.6079 311.6
[M]- 1050.6089 311.6
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.