CID 116606

Tetracosenylsuccinic anhydride

Structural Information

Molecular Formula
C28H50O3
SMILES
CCCCCCCCCCCCCC=CCCCCCCCCCC1CC(=O)OC1=O
InChI
InChI=1S/C28H50O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26-25-27(29)31-28(26)30/h14-15,26H,2-13,16-25H2,1H3
InChIKey
XVZYFNIOWXGZGH-UHFFFAOYSA-N
Compound name
3-tetracos-10-enyloxolane-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

434.376 Da
Monoisotopic Mass

11.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 435.38328 220.6
[M+Na]+ 457.36522 220.5
[M-H]- 433.36872 221.0
[M+NH4]+ 452.40982 230.9
[M+K]+ 473.33916 214.9
[M+H-H2O]+ 417.37326 212.4
[M+HCOO]- 479.37420 236.8
[M+CH3COO]- 493.38985 234.0
[M+Na-2H]- 455.35067 214.3
[M]+ 434.37545 228.8
[M]- 434.37655 228.8
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

No patent data available for this compound.