CID 5281969

Anandamide

Structural Information

Molecular Formula
C22H37NO2
SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCO
InChI
InChI=1S/C22H37NO2/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/h6-7,9-10,12-13,15-16,24H,2-5,8,11,14,17-21H2,1H3,(H,23,25)/b7-6-,10-9-,13-12-,16-15-
InChIKey
LGEQQWMQCRIYKG-DOFZRALJSA-N
Compound name
(5Z,8Z,11Z,14Z)-N-(2-hydroxyethyl)icosa-5,8,11,14-tetraenamide
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

3803
References

14461
Patents

347.28244 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 348.28972 194.9
[M+Na]+ 370.27166 195.7
[M-H]- 346.27516 191.0
[M+NH4]+ 365.31626 207.3
[M+K]+ 386.24560 188.8
[M+H-H2O]+ 330.27970 187.5
[M+HCOO]- 392.28064 213.5
[M+CH3COO]- 406.29629 214.8
[M+Na-2H]- 368.25711 192.1
[M]+ 347.28189 197.8
[M]- 347.28299 197.8
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