CID 6444518

Linoleamide, n-isopropyl-

Structural Information

Molecular Formula
C21H39NO
SMILES
CCCCC/C=C\C/C=C\CCCCCCCC(=O)NC(C)C
InChI
InChI=1S/C21H39NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(23)22-20(2)3/h8-9,11-12,20H,4-7,10,13-19H2,1-3H3,(H,22,23)/b9-8-,12-11-
InChIKey
GHLUXRXWPBHFNB-MURFETPASA-N
Compound name
(9Z,12Z)-N-propan-2-yloctadeca-9,12-dienamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2
Patents

321.30316 Da
Monoisotopic Mass

7.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.31044 189.9
[M+Na]+ 344.29238 196.1
[M+NH4]+ 339.33698 194.6
[M+K]+ 360.26632 187.9
[M-H]- 320.29588 188.4
[M+Na-2H]- 342.27783 189.2
[M]+ 321.30261 189.9
[M]- 321.30371 189.9
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