CID 9543156

Hydroxymethylnitramine

Structural Information

Molecular Formula
CH4N2O3
SMILES
C(N[N+](=O)[O-])O
InChI
InChI=1S/CH4N2O3/c4-1-2-3(5)6/h2,4H,1H2
InChIKey
JEXGCOGOSZPCEK-UHFFFAOYSA-N
Compound name
N-(hydroxymethyl)nitramide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3
Patents

92.022194 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 93.029470 110.3
[M+Na]+ 115.01141 117.5
[M-H]- 91.014918 109.9
[M+NH4]+ 110.05602 132.1
[M+K]+ 130.98535 114.1
[M+H-H2O]+ 75.019454 110.8
[M+HCOO]- 137.02040 136.8
[M+CH3COO]- 151.03604 156.9
[M+Na-2H]- 112.99686 120.6
[M]+ 92.021645 107.4
[M]- 92.022743 107.4
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.