CID 5283444

N-cis-11,14-eicosadienoyl ethanolamine

Structural Information

Molecular Formula
C22H41NO2
SMILES
CCCCC/C=C\C/C=C\CCCCCCCCCC(=O)NCCO
InChI
InChI=1S/C22H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)23-20-21-24/h6-7,9-10,24H,2-5,8,11-21H2,1H3,(H,23,25)/b7-6-,10-9-
InChIKey
MWQCBVWCBTUPDQ-HZJYTTRNSA-N
Compound name
(11Z,14Z)-N-(2-hydroxyethyl)icosa-11,14-dienamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

3
Patents

351.31372 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.32100 197.7
[M+Na]+ 374.30294 197.7
[M-H]- 350.30644 193.6
[M+NH4]+ 369.34754 209.8
[M+K]+ 390.27688 192.0
[M+H-H2O]+ 334.31098 190.0
[M+HCOO]- 396.31192 215.8
[M+CH3COO]- 410.32757 217.7
[M+Na-2H]- 372.28839 194.8
[M]+ 351.31317 202.1
[M]- 351.31427 202.1
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