CID 56604910

Mg(13:0/0:0/0:0)

Structural Information

Molecular Formula
C16H32O4
SMILES
CCCCCCCCCCCCC(=O)OC[C@@H](CO)O
InChI
InChI=1S/C16H32O4/c1-2-3-4-5-6-7-8-9-10-11-12-16(19)20-14-15(18)13-17/h15,17-18H,2-14H2,1H3/t15-/m1/s1
InChIKey
CLRCAFAXMVNJRH-OAHLLOKOSA-N
Compound name
[(2R)-2,3-dihydroxypropyl] tridecanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.23007 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.23735 174.6
[M+Na]+ 311.21929 180.5
[M+NH4]+ 306.26389 178.7
[M+K]+ 327.19323 175.4
[M-H]- 287.22279 170.9
[M+Na-2H]- 309.20474 173.2
[M]+ 288.22952 173.8
[M]- 288.23062 173.8
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.