CID 15932745

(tetrapropenyl)succinic acid

Structural Information

Molecular Formula
C16H22O4
SMILES
C=CCC(CC=C)(C(=O)O)C(CC=C)(CC=C)C(=O)O
InChI
InChI=1S/C16H22O4/c1-5-9-15(10-6-2,13(17)18)16(11-7-3,12-8-4)14(19)20/h5-8H,1-4,9-12H2,(H,17,18)(H,19,20)
InChIKey
GSONHGLQHNTBED-UHFFFAOYSA-N
Compound name
2,2,3,3-tetrakis(prop-2-enyl)butanedioic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

33
Patents

278.1518 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.15908 165.8
[M+Na]+ 301.14102 170.1
[M-H]- 277.14452 162.3
[M+NH4]+ 296.18562 180.2
[M+K]+ 317.11496 165.7
[M+H-H2O]+ 261.14906 161.6
[M+HCOO]- 323.15000 180.5
[M+CH3COO]- 337.16565 197.0
[M+Na-2H]- 299.12647 166.6
[M]+ 278.15125 166.5
[M]- 278.15235 166.5
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