CID 104357

Azelaic acid, diethanolamine amide

Structural Information

Molecular Formula
C17H34N2O6
SMILES
C(CCCC(=O)N(CCO)CCO)CCCC(=O)N(CCO)CCO
InChI
InChI=1S/C17H34N2O6/c20-12-8-18(9-13-21)16(24)6-4-2-1-3-5-7-17(25)19(10-14-22)11-15-23/h20-23H,1-15H2
InChIKey
PQHUNAMOLSBIAU-UHFFFAOYSA-N
Compound name
N,N,N',N'-tetrakis(2-hydroxyethyl)nonanediamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

362.2417 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.24898 191.3
[M+Na]+ 385.23092 190.5
[M-H]- 361.23442 186.6
[M+NH4]+ 380.27552 206.7
[M+K]+ 401.20486 190.0
[M+H-H2O]+ 345.23896 183.3
[M+HCOO]- 407.23990 207.1
[M+CH3COO]- 421.25555 217.8
[M+Na-2H]- 383.21637 187.5
[M]+ 362.24115 195.6
[M]- 362.24225 195.6
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