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]+ 345.29994 194.7
[M+Na]+ 367.28188 194.4
[M-H]- 343.28538 188.0
[M+NH4]+ 362.32648 205.7
[M+K]+ 383.25582 190.2
[M+H-H2O]+ 327.28992 187.7
[M+HCOO]- 389.29086 208.4
[M+CH3COO]- 403.30651 210.0
[M+Na-2H]- 365.26733 190.3
[M]+ 344.29211 199.2
[M]- 344.29321 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.