CID 6437767

63441-26-9

Structural Information

Molecular Formula
C40H75N3O
SMILES
CCCCCCCC/C=C\CCCCCCCC1=NCCN1CCNC(=O)CCCCCCC/C=C\CCCCCCCC
InChI
InChI=1S/C40H75N3O/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39-41-35-37-43(39)38-36-42-40(44)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20H,3-16,21-38H2,1-2H3,(H,42,44)/b19-17-,20-18-
InChIKey
VASZKKUIFVKZER-CLFAGFIQSA-N
Compound name
(Z)-N-[2-[2-[(Z)-heptadec-8-enyl]-4,5-dihydroimidazol-1-yl]ethyl]octadec-9-enamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

613.591 Da
Monoisotopic Mass

13.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 614.59828 274.2
[M+Na]+ 636.58022 270.3
[M+NH4]+ 631.62482 263.6
[M+K]+ 652.55416 268.8
[M-H]- 612.58372 249.7
[M+Na-2H]- 634.56567 269.6
[M]+ 613.59045 262.1
[M]- 613.59155 262.1
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.