CID 44146761

69929-09-5

Structural Information

Molecular Formula
C18H32N2O5
SMILES
CCCCCCCCCOC(=O)CC1=NC(CN1CCO)CC(=O)O
InChI
InChI=1S/C18H32N2O5/c1-2-3-4-5-6-7-8-11-25-18(24)13-16-19-15(12-17(22)23)14-20(16)9-10-21/h15,21H,2-14H2,1H3,(H,22,23)
InChIKey
XGDXQMYEHRASMH-UHFFFAOYSA-N
Compound name
2-[1-(2-hydroxyethyl)-2-(2-nonoxy-2-oxoethyl)-4,5-dihydroimidazol-4-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

356.2311 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.23838 189.1
[M+Na]+ 379.22032 192.0
[M-H]- 355.22382 185.8
[M+NH4]+ 374.26492 199.6
[M+K]+ 395.19426 189.1
[M+H-H2O]+ 339.22836 180.8
[M+HCOO]- 401.22930 203.8
[M+CH3COO]- 415.24495 210.7
[M+Na-2H]- 377.20577 184.9
[M]+ 356.23055 194.0
[M]- 356.23165 194.0
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.