CID 42629247

60168-81-2

Structural Information

Molecular Formula
C4H9NO4
SMILES
C(C(O)O)OC(=O)CN
InChI
InChI=1S/C4H9NO4/c5-1-4(8)9-2-3(6)7/h3,6-7H,1-2,5H2
InChIKey
BHSPAXISBGUYLI-UHFFFAOYSA-N
Compound name
2,2-dihydroxyethyl 2-aminoacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

439
Patents

135.05316 Da
Monoisotopic Mass

-2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.06044 126.1
[M+Na]+ 158.04238 132.8
[M+NH4]+ 153.08698 131.5
[M+K]+ 174.01632 131.3
[M-H]- 134.04588 122.9
[M+Na-2H]- 156.02783 126.9
[M]+ 135.05261 125.5
[M]- 135.05371 125.5
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