CID 6455364

Disodium (tetrapropenyl)succinate

Structural Information

Molecular Formula
C16H22O4
SMILES
C/C=C/C(C(C(=O)O)(/C=C/C)/C=C/C)(C(=O)O)/C=C/C
InChI
InChI=1S/C16H22O4/c1-5-9-15(10-6-2,13(17)18)16(11-7-3,12-8-4)14(19)20/h5-12H,1-4H3,(H,17,18)(H,19,20)/b9-5+,10-6+,11-7+,12-8+
InChIKey
GGQRKYMKYMRZTF-HFBXSBKTSA-N
Compound name
2,2,3,3-tetrakis[(E)-prop-1-enyl]butanedioic acid
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

2930
Patents

278.1518 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.159076 166.7
[M+Na]+ 301.141018 171.4
[M-H]- 277.144524 163.4
[M+NH4]+ 296.185623 181.5
[M+K]+ 317.114958 167.0
[M+H-H2O]+ 261.149060 162.7
[M+HCOO]- 323.150001 181.5
[M+CH3COO]- 337.165651 194.3
[M+Na-2H]- 299.126466 167.4
[M]+ 278.15125142 167.1
[M]- 278.15234858 167.1
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.