CID 3016168

N,n'-diacetyloxamide

Structural Information

Molecular Formula
C6H8N2O4
SMILES
CC(=O)NC(=O)C(=O)NC(=O)C
InChI
InChI=1S/C6H8N2O4/c1-3(9)7-5(11)6(12)8-4(2)10/h1-2H3,(H,7,9,11)(H,8,10,12)
InChIKey
YKLXUKBPDJLLMU-UHFFFAOYSA-N
Compound name
N,N'-diacetyloxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

172.0484 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.055676 134.8
[M+Na]+ 195.037618 140.7
[M-H]- 171.041124 135.5
[M+NH4]+ 190.082223 154.3
[M+K]+ 211.011558 141.9
[M+H-H2O]+ 155.045660 129.3
[M+HCOO]- 217.046601 158.4
[M+CH3COO]- 231.062251 181.7
[M+Na-2H]- 193.023066 137.3
[M]+ 172.04785142 134.3
[M]- 172.04894858 134.3
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