CID 131751819

6-hydroxy-8-pentacosanone

Structural Information

Molecular Formula
C25H50O2
SMILES
CCCCCCCCCCCCCCCCCC(=O)CC(CCCCC)O
InChI
InChI=1S/C25H50O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-20-22-25(27)23-24(26)21-19-6-4-2/h24,26H,3-23H2,1-2H3
InChIKey
GWONURZMUVCQJN-UHFFFAOYSA-N
Compound name
6-hydroxypentacosan-8-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

382.38107 Da
Monoisotopic Mass

10.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.38835 207.6
[M+Na]+ 405.37029 213.2
[M+NH4]+ 400.41489 214.8
[M+K]+ 421.34423 204.6
[M-H]- 381.37379 205.2
[M+Na-2H]- 403.35574 205.5
[M]+ 382.38052 207.3
[M]- 382.38162 207.3
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

No patent data available for this compound.