CID 121232738

N-methyl-n-(nitrosomethyl)ethenamine

Structural Information

Molecular Formula
C4H8N2O
SMILES
CN(CN=O)C=C
InChI
InChI=1S/C4H8N2O/c1-3-6(2)4-5-7/h3H,1,4H2,2H3
InChIKey
MFCHWYSOGVAXNC-UHFFFAOYSA-N
Compound name
N-methyl-N-(nitrosomethyl)ethenamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

100.06366 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 101.070936 116.9
[M+Na]+ 123.052878 124.4
[M-H]- 99.056384 120.4
[M+NH4]+ 118.097483 140.9
[M+K]+ 139.026818 126.2
[M+H-H2O]+ 83.060920 111.6
[M+HCOO]- 145.061861 146.0
[M+CH3COO]- 159.077511 177.1
[M+Na-2H]- 121.038326 125.3
[M]+ 100.06311142 119.0
[M]- 100.06420858 119.0
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.