CID 22223

Dtxsid00974813

Structural Information

Molecular Formula
C3H7NO3
SMILES
COC(=O)CON
InChI
InChI=1S/C3H7NO3/c1-6-3(5)2-7-4/h2,4H2,1H3
InChIKey
DDNYYGSSEPOGRP-UHFFFAOYSA-N
Compound name
methyl 2-aminooxyacetate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

176
Patents

105.042595 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 106.049871 117.3
[M+Na]+ 128.031813 124.9
[M-H]- 104.035319 117.5
[M+NH4]+ 123.076418 139.7
[M+K]+ 144.005753 126.3
[M+H-H2O]+ 88.039855 112.6
[M+HCOO]- 150.040796 142.4
[M+CH3COO]- 164.056446 167.4
[M+Na-2H]- 126.017261 123.8
[M]+ 105.04204642 118.5
[M]- 105.04314358 118.5
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