CID 6441625

Ricinoleamide dea

Structural Information

Molecular Formula
C22H43NO4
SMILES
CCCCCC[C@H](C/C=C\CCCCCCCC(=O)N(CCO)CCO)O
InChI
InChI=1S/C22H43NO4/c1-2-3-4-11-14-21(26)15-12-9-7-5-6-8-10-13-16-22(27)23(17-19-24)18-20-25/h9,12,21,24-26H,2-8,10-11,13-20H2,1H3/b12-9-/t21-/m1/s1
InChIKey
PDVQCPFKYPYROG-ZDKIGPTLSA-N
Compound name
(Z,12R)-12-hydroxy-N,N-bis(2-hydroxyethyl)octadec-9-enamide
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

580
Patents

385.3192 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 386.32648 206.0
[M+Na]+ 408.30842 204.6
[M-H]- 384.31192 200.5
[M+NH4]+ 403.35302 211.1
[M+K]+ 424.28236 200.8
[M+H-H2O]+ 368.31646 198.2
[M+HCOO]- 430.31740 216.2
[M+CH3COO]- 444.33305 222.1
[M+Na-2H]- 406.29387 200.2
[M]+ 385.31865 210.8
[M]- 385.31975 210.8
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

No patent data available for this compound.