CID 21989178

97173-34-7

Structural Information

Molecular Formula

C₆H₁₅NO₃

SMILES

CC(CN(CC(C)O)O)O

InChI

InChI=1S/C6H15NO3/c1-5(8)3-7(10)4-6(2)9/h5-6,8-10H,3-4H2,1-2H3

InChIKey

JYOCWMVETLTCNF-UHFFFAOYSA-N

Compound name

1-[hydroxy(2-hydroxypropyl)amino]propan-2-ol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 184
Patents: 149.1052 Da
Monoisotopic Mass: -0.7
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]+	150.11248	132.9
[M+Na]+	172.09442	139.5
[M+NH4]+	167.13902	138.9
[M+K]+	188.06836	137.7
[M-H]-	148.09792	130.4
[M+Na-2H]-	170.07987	133.9
[M]+	149.10465	132.5
[M]-	149.10575	132.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe