CID 57148941

2-(2-acetamidoethoxy)acetic acid

Structural Information

Molecular Formula
C6H11NO4
SMILES
CC(=O)NCCOCC(=O)O
InChI
InChI=1S/C6H11NO4/c1-5(8)7-2-3-11-4-6(9)10/h2-4H2,1H3,(H,7,8)(H,9,10)
InChIKey
BLFNGWLVKATGEE-UHFFFAOYSA-N
Compound name
2-(2-acetamidoethoxy)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

161.0688 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.07608 133.0
[M+Na]+ 184.05802 138.9
[M-H]- 160.06152 131.8
[M+NH4]+ 179.10262 152.5
[M+K]+ 200.03196 139.3
[M+H-H2O]+ 144.06606 127.8
[M+HCOO]- 206.06700 155.6
[M+CH3COO]- 220.08265 176.6
[M+Na-2H]- 182.04347 137.2
[M]+ 161.06825 134.5
[M]- 161.06935 134.5
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