CID 14259007

10,20-dihydroxyeicosanoic acid

Structural Information

Molecular Formula
C20H40O4
SMILES
C(CCCCCO)CCCCC(CCCCCCCCC(=O)O)O
InChI
InChI=1S/C20H40O4/c21-18-14-10-6-2-1-3-7-11-15-19(22)16-12-8-4-5-9-13-17-20(23)24/h19,21-22H,1-18H2,(H,23,24)
InChIKey
RIIQXYZWFWMFSB-UHFFFAOYSA-N
Compound name
10,20-dihydroxyicosanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.29266 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.299936 194.7
[M+Na]+ 367.281878 194.4
[M-H]- 343.285384 188.0
[M+NH4]+ 362.326483 205.7
[M+K]+ 383.255818 190.2
[M+H-H2O]+ 327.289920 187.7
[M+HCOO]- 389.290861 208.4
[M+CH3COO]- 403.306511 210.0
[M+Na-2H]- 365.267326 190.3
[M]+ 344.29211142 199.2
[M]- 344.29320858 199.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.