CID 5283396

N-butyl arachidonoyl amine

Structural Information

Molecular Formula
C24H41NO
SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCCC
InChI
InChI=1S/C24H41NO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24(26)25-23-6-4-2/h9-10,12-13,15-16,18-19H,3-8,11,14,17,20-23H2,1-2H3,(H,25,26)/b10-9-,13-12-,16-15-,19-18-
InChIKey
UFBCBSNKWKPSRJ-SNPVRQPZSA-N
Compound name
(5Z,8Z,11Z,14Z)-N-butylicosa-5,8,11,14-tetraenamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

359.31882 Da
Monoisotopic Mass

7.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 360.32610 200.5
[M+Na]+ 382.30804 201.0
[M-H]- 358.31154 197.7
[M+NH4]+ 377.35264 213.1
[M+K]+ 398.28198 193.9
[M+H-H2O]+ 342.31608 192.7
[M+HCOO]- 404.31702 219.7
[M+CH3COO]- 418.33267 221.4
[M+Na-2H]- 380.29349 197.1
[M]+ 359.31827 204.7
[M]- 359.31937 204.7
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

No patent data available for this compound.