CID 6436424

15566-80-0

Structural Information

Molecular Formula
C22H45N3O
SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)NCCNCCN
InChI
InChI=1S/C22H45N3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(26)25-21-20-24-19-18-23/h9-10,24H,2-8,11-21,23H2,1H3,(H,25,26)/b10-9-
InChIKey
FUJIFZPMNJHIDG-KTKRTIGZSA-N
Compound name
(Z)-N-[2-(2-aminoethylamino)ethyl]octadec-9-enamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

20
Patents

367.35626 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 368.36354 201.4
[M+Na]+ 390.34548 204.7
[M+NH4]+ 385.39008 205.0
[M+K]+ 406.31942 196.6
[M-H]- 366.34898 200.5
[M+Na-2H]- 388.33093 199.8
[M]+ 367.35571 200.8
[M]- 367.35681 200.8
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

patents stripe