CID 119111

58840-25-8

Structural Information

Molecular Formula
C2H6N2O2
SMILES
CN(CO)N=O
InChI
InChI=1S/C2H6N2O2/c1-4(2-5)3-6/h5H,2H2,1H3
InChIKey
CDKXZKUBCGJTDG-UHFFFAOYSA-N
Compound name
N-(hydroxymethyl)-N-methylnitrous amide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

6
Patents

90.04293 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 91.050206 112.5
[M+Na]+ 113.03215 120.0
[M-H]- 89.035654 114.8
[M+NH4]+ 108.07675 136.2
[M+K]+ 129.00609 122.5
[M+H-H2O]+ 73.040190 107.5
[M+HCOO]- 135.04113 140.8
[M+CH3COO]- 149.05678 171.2
[M+Na-2H]- 111.01760 121.4
[M]+ 90.042381 114.1
[M]- 90.043479 114.1
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.