CID 54592891

1-amino-3-methoxy-2-methylpropan-2-ol

Structural Information

Molecular Formula
C5H13NO2
SMILES
CC(CN)(COC)O
InChI
InChI=1S/C5H13NO2/c1-5(7,3-6)4-8-2/h7H,3-4,6H2,1-2H3
InChIKey
XADTUXGTPMQVJD-UHFFFAOYSA-N
Compound name
1-amino-3-methoxy-2-methylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

119.09463 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 120.101906 125.4
[M+Na]+ 142.083848 132.2
[M-H]- 118.087354 124.1
[M+NH4]+ 137.128453 146.9
[M+K]+ 158.057788 132.1
[M+H-H2O]+ 102.091890 121.4
[M+HCOO]- 164.092831 147.3
[M+CH3COO]- 178.108481 169.9
[M+Na-2H]- 140.069296 132.2
[M]+ 119.09408142 124.9
[M]- 119.09517858 124.9
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

patents stripe