CID 81151

Methyl methylcarbamate

Structural Information

Molecular Formula
C3H7NO2
SMILES
CNC(=O)OC
InChI
InChI=1S/C3H7NO2/c1-4-3(5)6-2/h1-2H3,(H,4,5)
InChIKey
NYXHSRNBKJIQQG-UHFFFAOYSA-N
Compound name
methyl N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

6432
Patents

89.047676 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 90.054952 114.3
[M+Na]+ 112.036894 122.1
[M-H]- 88.040400 115.3
[M+NH4]+ 107.081499 137.9
[M+K]+ 128.010834 123.5
[M+H-H2O]+ 72.044936 110.0
[M+HCOO]- 134.045877 139.9
[M+CH3COO]- 148.061527 165.3
[M+Na-2H]- 110.022342 122.0
[M]+ 89.04712742 115.0
[M]- 89.04822458 115.0
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

patents stripe