CID 131751008

N-isobutyl-2,4,8-eicosatrienamide

Structural Information

Molecular Formula
C24H43NO
SMILES
CCCCCCCCCCC/C=C\CC/C=C/C=C\C(=O)NCC(C)C
InChI
InChI=1S/C24H43NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(26)25-22-23(2)3/h14-15,18-21,23H,4-13,16-17,22H2,1-3H3,(H,25,26)/b15-14-,19-18+,21-20-
InChIKey
WBBCNGSATYECFE-LSJCJZQESA-N
Compound name
(2Z,4E,8Z)-N-(2-methylpropyl)icosa-2,4,8-trienamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

361.33447 Da
Monoisotopic Mass

8.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.341746 203.0
[M+Na]+ 384.323688 203.0
[M-H]- 360.327194 200.3
[M+NH4]+ 379.368293 215.6
[M+K]+ 400.297628 197.0
[M+H-H2O]+ 344.331730 195.3
[M+HCOO]- 406.332671 221.0
[M+CH3COO]- 420.348321 223.6
[M+Na-2H]- 382.309136 198.3
[M]+ 361.33392142 207.3
[M]- 361.33501858 207.3
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

patents stripe