CID 6913468

93-81-2

Structural Information

Molecular Formula
C22H44N2O2
SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)N(CCN)CCO
InChI
InChI=1S/C22H44N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(26)24(19-18-23)20-21-25/h9-10,25H,2-8,11-21,23H2,1H3/b10-9-
InChIKey
ZCIHUYWGDQQFCS-KTKRTIGZSA-N
Compound name
(Z)-N-(2-aminoethyl)-N-(2-hydroxyethyl)octadec-9-enamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1
Patents

368.34027 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 369.34755 201.2
[M+Na]+ 391.32949 205.1
[M+NH4]+ 386.37409 204.7
[M+K]+ 407.30343 197.9
[M-H]- 367.33299 199.4
[M+Na-2H]- 389.31494 199.2
[M]+ 368.33972 200.6
[M]- 368.34082 200.6
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