CID 115660

64011-44-5

Structural Information

Molecular Formula

C₆H₁₅NO₂

SMILES

CC(CC(C)(N)OC)O

InChI

InChI=1S/C6H15NO2/c1-5(8)4-6(2,7)9-3/h5,8H,4,7H2,1-3H3

InChIKey

BJTHUIGHIKEJLS-UHFFFAOYSA-N

Compound name

4-amino-4-methoxypentan-2-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 133.11028 Da
Monoisotopic Mass: -0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	134.11756	128.8
[M+Na]+	156.09950	136.7
[M+NH4]+	151.14410	135.7
[M+K]+	172.07344	133.8
[M-H]-	132.10300	127.1
[M+Na-2H]-	154.08495	131.2
[M]+	133.10973	129.1
[M]-	133.11083	129.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.