CID 3018078

71141-89-4

Structural Information

Molecular Formula
C28H55N3O
SMILES
CCCCCCCCCCCC1=NCCN1CCNC(=O)CCCCCCCCCCC
InChI
InChI=1S/C28H55N3O/c1-3-5-7-9-11-13-15-17-19-21-27-29-23-25-31(27)26-24-30-28(32)22-20-18-16-14-12-10-8-6-4-2/h3-26H2,1-2H3,(H,30,32)
InChIKey
HGHDDUWCTTUOMJ-UHFFFAOYSA-N
Compound name
N-[2-(2-undecyl-4,5-dihydroimidazol-1-yl)ethyl]dodecanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

449.4345 Da
Monoisotopic Mass

9.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 450.44178 225.7
[M+Na]+ 472.42372 223.8
[M-H]- 448.42722 222.6
[M+NH4]+ 467.46832 233.6
[M+K]+ 488.39766 217.9
[M+H-H2O]+ 432.43176 214.5
[M+HCOO]- 494.43270 240.9
[M+CH3COO]- 508.44835 240.7
[M+Na-2H]- 470.40917 219.2
[M]+ 449.43395 232.4
[M]- 449.43505 232.4
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