CID 89675

2-amino-n-methylacetamide

Structural Information

Molecular Formula
C3H8N2O
SMILES
CNC(=O)CN
InChI
InChI=1S/C3H8N2O/c1-5-3(6)2-4/h2,4H2,1H3,(H,5,6)
InChIKey
UUYDPHCMCYSNAY-UHFFFAOYSA-N
Compound name
2-amino-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

1766
Patents

88.06366 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 89.070936 115.9
[M+Na]+ 111.052878 122.7
[M-H]- 87.056384 116.1
[M+NH4]+ 106.097483 138.7
[M+K]+ 127.026818 123.1
[M+H-H2O]+ 71.060920 111.1
[M+HCOO]- 133.061861 141.4
[M+CH3COO]- 147.077511 168.2
[M+Na-2H]- 109.038326 122.5
[M]+ 88.06311142 113.3
[M]- 88.06420858 113.3
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