CID 5282273

150314-35-5

Structural Information

Molecular Formula
C24H41NO2
SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)NCCO
InChI
InChI=1S/C24H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(27)25-22-23-26/h6-7,9-10,12-13,15-16,26H,2-5,8,11,14,17-23H2,1H3,(H,25,27)/b7-6-,10-9-,13-12-,16-15-
InChIKey
FMVHVRYFQIXOAF-DOFZRALJSA-N
Compound name
(7Z,10Z,13Z,16Z)-N-(2-hydroxyethyl)docosa-7,10,13,16-tetraenamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

12
References

71
Patents

375.31372 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 376.32100 204.1
[M+Na]+ 398.30294 209.1
[M+NH4]+ 393.34754 207.0
[M+K]+ 414.27688 200.0
[M-H]- 374.30644 201.1
[M+Na-2H]- 396.28839 201.7
[M]+ 375.31317 203.2
[M]- 375.31427 203.2
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