CID 171117693

20e-tetracosenoic acid

Structural Information

Molecular Formula
C24H46O2
SMILES
CCC/C=C/CCCCCCCCCCCCCCCCCCC(=O)O
InChI
InChI=1S/C24H46O2/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)26/h4-5H,2-3,6-23H2,1H3,(H,25,26)/b5-4+
InChIKey
SZPFBJQAKQWHBW-SNAWJCMRSA-N
Compound name
(E)-tetracos-20-enoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

366.3498 Da
Monoisotopic Mass

10.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.35708 204.3
[M+Na]+ 389.33902 204.0
[M-H]- 365.34252 199.8
[M+NH4]+ 384.38362 216.2
[M+K]+ 405.31296 198.3
[M+H-H2O]+ 349.34706 196.7
[M+HCOO]- 411.34800 220.5
[M+CH3COO]- 425.36365 220.8
[M+Na-2H]- 387.32447 200.0
[M]+ 366.34925 211.2
[M]- 366.35035 211.2
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.