CID 6440264

Tetracosatetraenoic acid

Structural Information

Molecular Formula
C24H40O2
SMILES
CCCCCCCCCCCCCCC/C=C/C=C/C=C/C=C/C(=O)O
InChI
InChI=1S/C24H40O2/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/h16-23H,2-15H2,1H3,(H,25,26)/b17-16+,19-18+,21-20+,23-22+
InChIKey
RZHACVKGHNMWOP-ZWZRQGCWSA-N
Compound name
(2E,4E,6E,8E)-tetracosa-2,4,6,8-tetraenoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

1827
Patents

360.30283 Da
Monoisotopic Mass

10.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.31011 199.7
[M+Na]+ 383.29205 200.6
[M-H]- 359.29555 195.5
[M+NH4]+ 378.33665 211.8
[M+K]+ 399.26599 193.1
[M+H-H2O]+ 343.30009 192.5
[M+HCOO]- 405.30103 216.6
[M+CH3COO]- 419.31668 216.5
[M+Na-2H]- 381.27750 195.7
[M]+ 360.30228 204.3
[M]- 360.30338 204.3
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