CID 536072

N,n,o-triacetylhydroxylamine

Structural Information

Molecular Formula
C6H9NO4
SMILES
CC(=O)N(C(=O)C)OC(=O)C
InChI
InChI=1S/C6H9NO4/c1-4(8)7(5(2)9)11-6(3)10/h1-3H3
InChIKey
NGULNJDDRUSDPR-UHFFFAOYSA-N
Compound name
(diacetylamino) acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

341
Patents

159.05316 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.06044 130.3
[M+Na]+ 182.04238 137.4
[M-H]- 158.04588 132.5
[M+NH4]+ 177.08698 151.6
[M+K]+ 198.01632 140.0
[M+H-H2O]+ 142.05042 125.3
[M+HCOO]- 204.05136 154.4
[M+CH3COO]- 218.06701 180.8
[M+Na-2H]- 180.02783 133.4
[M]+ 159.05261 133.6
[M]- 159.05371 133.6
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

No patent data available for this compound.