CID 5283404

N-(1,1-dimethyl-2-hydroxy-ethyl) arachidonoyl amine

Structural Information

Molecular Formula
C24H41NO2
SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NC(C)(C)CO
InChI
InChI=1S/C24H41NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(27)25-24(2,3)22-26/h8-9,11-12,14-15,17-18,26H,4-7,10,13,16,19-22H2,1-3H3,(H,25,27)/b9-8-,12-11-,15-14-,18-17-
InChIKey
BJEGAFQVEFFEEW-GKFVBPDJSA-N
Compound name
(5Z,8Z,11Z,14Z)-N-(1-hydroxy-2-methylpropan-2-yl)icosa-5,8,11,14-tetraenamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

375.31372 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 376.32100 203.8
[M+Na]+ 398.30294 204.3
[M-H]- 374.30644 199.9
[M+NH4]+ 393.34754 205.4
[M+K]+ 414.27688 197.3
[M+H-H2O]+ 358.31098 196.8
[M+HCOO]- 420.31192 220.2
[M+CH3COO]- 434.32757 221.0
[M+Na-2H]- 396.28839 200.9
[M]+ 375.31317 207.0
[M]- 375.31427 207.0
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.