CID 3332061

2-aminoprop-2-enamide

Structural Information

Molecular Formula
C3H6N2O
SMILES
C=C(C(=O)N)N
InChI
InChI=1S/C3H6N2O/c1-2(4)3(5)6/h1,4H2,(H2,5,6)
InChIKey
IUMRWGYGZHKZKF-UHFFFAOYSA-N
Compound name
2-aminoprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1740
Patents

86.04801 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 87.055286 115.4
[M+Na]+ 109.03723 122.2
[M-H]- 85.040734 115.2
[M+NH4]+ 104.08183 137.8
[M+K]+ 125.01117 122.1
[M+H-H2O]+ 69.045270 110.7
[M+HCOO]- 131.04621 139.5
[M+CH3COO]- 145.06186 168.2
[M+Na-2H]- 107.02268 119.6
[M]+ 86.047461 110.5
[M]- 86.048559 110.5
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.