CID 87212188

[(2r)-2-hydroxy-3-methoxypropyl]dimethylamine

Structural Information

Molecular Formula

C₆H₁₅NO₂

SMILES

CN(C)C[C@H](COC)O

InChI

InChI=1S/C6H15NO2/c1-7(2)4-6(8)5-9-3/h6,8H,4-5H2,1-3H3/t6-/m1/s1

InChIKey

ZJPPXYURVIFMMF-ZCFIWIBFSA-N

Compound name

(2R)-1-(dimethylamino)-3-methoxypropan-2-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 15
Patents: 133.11028 Da
Monoisotopic Mass: -0.5
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]+	134.117556	130.0
[M+Na]+	156.099498	135.9
[M-H]-	132.103004	130.4
[M+NH4]+	151.144103	151.7
[M+K]+	172.073438	137.5
[M+H-H2O]+	116.107540	125.0
[M+HCOO]-	178.108481	153.3
[M+CH3COO]-	192.124131	177.6
[M+Na-2H]-	154.084946	134.7
[M]+	133.10973142	132.0
[M]-	133.11082858	132.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe