CID 7163

N,n-bis(2-hydroxyethyl)stearamide

Structural Information

Molecular Formula
C22H45NO3
SMILES
CCCCCCCCCCCCCCCCCC(=O)N(CCO)CCO
InChI
InChI=1S/C22H45NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(26)23(18-20-24)19-21-25/h24-25H,2-21H2,1H3
InChIKey
XGZOMURMPLSSKQ-UHFFFAOYSA-N
Compound name
N,N-bis(2-hydroxyethyl)octadecanamide
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

6532
Patents

371.33994 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.34722 204.1
[M+Na]+ 394.32916 203.0
[M-H]- 370.33266 199.9
[M+NH4]+ 389.37376 215.3
[M+K]+ 410.30310 199.6
[M+H-H2O]+ 354.33720 196.0
[M+HCOO]- 416.33814 221.0
[M+CH3COO]- 430.35379 223.3
[M+Na-2H]- 392.31461 199.9
[M]+ 371.33939 210.9
[M]- 371.34049 210.9
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.