CID 14367036

2-amino-2-methylbutanamide

Structural Information

Molecular Formula
C5H12N2O
SMILES
CCC(C)(C(=O)N)N
InChI
InChI=1S/C5H12N2O/c1-3-5(2,7)4(6)8/h3,7H2,1-2H3,(H2,6,8)
InChIKey
YLYOSYIKDVALRB-UHFFFAOYSA-N
Compound name
2-amino-2-methylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

94
Patents

116.09496 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 117.102236 124.9
[M+Na]+ 139.084178 131.3
[M-H]- 115.087684 124.5
[M+NH4]+ 134.128783 146.4
[M+K]+ 155.058118 131.2
[M+H-H2O]+ 99.092220 120.4
[M+HCOO]- 161.093161 147.6
[M+CH3COO]- 175.108811 174.6
[M+Na-2H]- 137.069626 130.0
[M]+ 116.09441142 121.6
[M]- 116.09550858 121.6
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