CID 206611

Methylamine, n-chloro-n-nitro-

Structural Information

Molecular Formula
CH3ClN2O2
SMILES
CN([N+](=O)[O-])Cl
InChI
InChI=1S/CH3ClN2O2/c1-3(2)4(5)6/h1H3
InChIKey
OIAKCZCVYHBOAB-UHFFFAOYSA-N
Compound name
N-chloro-N-methylnitramide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

109.988304 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 110.99558 114.5
[M+Na]+ 132.97752 122.7
[M-H]- 108.98103 116.6
[M+NH4]+ 128.02213 137.6
[M+K]+ 148.95146 119.4
[M+H-H2O]+ 92.985564 115.9
[M+HCOO]- 154.98650 138.1
[M+CH3COO]- 169.00216 165.4
[M+Na-2H]- 130.96297 123.6
[M]+ 109.98776 115.1
[M]- 109.98885 115.1
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.