CID 5283393

85146-53-8

Structural Information

Molecular Formula
C20H33NO
SMILES
CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)N
InChI
InChI=1S/C20H33NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H2,21,22)/b7-6-,10-9-,13-12-,16-15-
InChIKey
BNBSCAZCQDLUDU-DOFZRALJSA-N
Compound name
(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

6
References

558
Patents

303.25623 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.263506 183.2
[M+Na]+ 326.245448 185.3
[M-H]- 302.248954 180.6
[M+NH4]+ 321.290053 197.8
[M+K]+ 342.219388 178.9
[M+H-H2O]+ 286.253490 176.2
[M+HCOO]- 348.254431 203.1
[M+CH3COO]- 362.270081 209.4
[M+Na-2H]- 324.230896 180.9
[M]+ 303.25568142 184.9
[M]- 303.25677858 184.9
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