CID 11954189

6-decylubiquinol

Structural Information

Molecular Formula
C19H32O4
SMILES
CCCCCCCCCCC1=C(C(=C(C(=C1O)OC)OC)O)C
InChI
InChI=1S/C19H32O4/c1-5-6-7-8-9-10-11-12-13-15-14(2)16(20)18(22-3)19(23-4)17(15)21/h20-21H,5-13H2,1-4H3
InChIKey
FZPHMACGWIAGFA-UHFFFAOYSA-N
Compound name
2-decyl-5,6-dimethoxy-3-methylbenzene-1,4-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

22
References

110
Patents

324.23007 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.23735 180.7
[M+Na]+ 347.21929 187.3
[M-H]- 323.22279 181.4
[M+NH4]+ 342.26389 194.8
[M+K]+ 363.19323 183.6
[M+H-H2O]+ 307.22733 174.1
[M+HCOO]- 369.22827 199.6
[M+CH3COO]- 383.24392 210.4
[M+Na-2H]- 345.20474 179.2
[M]+ 324.22952 188.3
[M]- 324.23062 188.3
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

patents stripe