CID 131751108

Filfiline

Structural Information

Molecular Formula
C26H47NO
SMILES
CCCCCCCCCCC/C=C\CCCC/C=C\C=C/C(=O)NCC(C)C
InChI
InChI=1S/C26H47NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26(28)27-24-25(2)3/h14-15,20-23,25H,4-13,16-19,24H2,1-3H3,(H,27,28)/b15-14-,21-20-,23-22-
InChIKey
KDMZDJSBTQFEKT-RUAVVDHUSA-N
Compound name
(2Z,4Z,10Z)-N-(2-methylpropyl)docosa-2,4,10-trienamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

389.36575 Da
Monoisotopic Mass

10.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 390.37303 211.7
[M+Na]+ 412.35497 210.8
[M-H]- 388.35847 208.5
[M+NH4]+ 407.39957 223.1
[M+K]+ 428.32891 204.3
[M+H-H2O]+ 372.36301 203.6
[M+HCOO]- 434.36395 229.0
[M+CH3COO]- 448.37960 229.5
[M+Na-2H]- 410.34042 206.0
[M]+ 389.36520 216.8
[M]- 389.36630 216.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.