CID 20841414

71850-72-1

Structural Information

Molecular Formula
C24H33O12Sb
SMILES
CCCCOC(=O)/C=C\C(=O)O[Sb](OC(=O)/C=C\C(=O)OCCCC)OC(=O)/C=C\C(=O)OCCCC
InChI
InChI=1S/3C8H12O4.Sb/c3*1-2-3-6-12-8(11)5-4-7(9)10;/h3*4-5H,2-3,6H2,1H3,(H,9,10);/q;;;+3/p-3/b3*5-4-;
InChIKey
UWAMGQKEHUQPTG-VNGPFPIXSA-K
Compound name
4-O-bis[[(Z)-4-butoxy-4-oxobut-2-enoyl]oxy]stibanyl 1-O-butyl (Z)-but-2-enedioate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

634.101 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 635.10828 231.4
[M+Na]+ 657.09022 233.2
[M+NH4]+ 652.13482 239.8
[M+K]+ 673.06416 234.3
[M-H]- 633.09372 233.1
[M+Na-2H]- 655.07567 237.4
[M]+ 634.10045 233.1
[M]- 634.10155 233.1
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.