CID 9543151

Bis(hydroxymethyl)nitramine

Structural Information

Molecular Formula
C2H6N2O4
SMILES
C(N(CO)[N+](=O)[O-])O
InChI
InChI=1S/C2H6N2O4/c5-1-3(2-6)4(7)8/h5-6H,1-2H2
InChIKey
WRZHBAUINPFLED-UHFFFAOYSA-N
Compound name
N,N-bis(hydroxymethyl)nitramide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

122.03275 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 123.04003 118.6
[M+Na]+ 145.02197 127.5
[M+NH4]+ 140.06657 125.2
[M+K]+ 160.99591 127.6
[M-H]- 121.02547 118.2
[M+Na-2H]- 143.00742 121.3
[M]+ 122.03220 119.1
[M]- 122.03330 119.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.