CID 20120

Dimethylnitramine

Structural Information

Molecular Formula
C2H6N2O2
SMILES
CN(C)[N+](=O)[O-]
InChI
InChI=1S/C2H6N2O2/c1-3(2)4(5)6/h1-2H3
InChIKey
XRWKADIRZXTTLH-UHFFFAOYSA-N
Compound name
N,N-dimethylnitramide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

47
References

244
Patents

90.04293 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 91.050206 112.2
[M+Na]+ 113.03215 119.7
[M-H]- 89.035654 114.6
[M+NH4]+ 108.07675 135.5
[M+K]+ 129.00609 118.1
[M+H-H2O]+ 73.040190 112.4
[M+HCOO]- 135.04113 140.2
[M+CH3COO]- 149.05678 164.5
[M+Na-2H]- 111.01760 121.6
[M]+ 90.042381 111.4
[M]- 90.043479 111.4
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.