CID 17085

Tricosanoic acid

Structural Information

Molecular Formula
C23H46O2
SMILES
CCCCCCCCCCCCCCCCCCCCCCC(=O)O
InChI
InChI=1S/C23H46O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25/h2-22H2,1H3,(H,24,25)
InChIKey
XEZVDURJDFGERA-UHFFFAOYSA-N
Compound name
tricosanoic acid
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

18
References

7720
Patents

354.3498 Da
Monoisotopic Mass

10.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.35708 201.4
[M+Na]+ 377.33902 201.2
[M-H]- 353.34252 197.1
[M+NH4]+ 372.38362 213.8
[M+K]+ 393.31296 196.3
[M+H-H2O]+ 337.34706 193.9
[M+HCOO]- 399.34800 217.7
[M+CH3COO]- 413.36365 219.3
[M+Na-2H]- 375.32447 197.6
[M]+ 354.34925 208.8
[M]- 354.35035 208.8
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.