CID 5283433

Arachidonoylmorpholine

Structural Information

Molecular Formula
C24H39NO2
SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)N1CCOCC1
InChI
InChI=1S/C24H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24(26)25-20-22-27-23-21-25/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-23H2,1H3/b7-6-,10-9-,13-12-,16-15-
InChIKey
RUKZVIXSXGGFHW-DOFZRALJSA-N
Compound name
(5Z,8Z,11Z,14Z)-1-morpholin-4-ylicosa-5,8,11,14-tetraen-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

1
Patents

373.29807 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.30535 202.2
[M+Na]+ 396.28729 201.8
[M-H]- 372.29079 201.2
[M+NH4]+ 391.33189 211.3
[M+K]+ 412.26123 196.0
[M+H-H2O]+ 356.29533 192.9
[M+HCOO]- 418.29627 215.7
[M+CH3COO]- 432.31192 217.7
[M+Na-2H]- 394.27274 199.2
[M]+ 373.29752 202.7
[M]- 373.29862 202.7
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