CID 13418628

79365-81-4

Structural Information

Molecular Formula

C₈H₁₉NO₂

SMILES

CC(C)(CNCC(C)(C)O)O

InChI

InChI=1S/C8H19NO2/c1-7(2,10)5-9-6-8(3,4)11/h9-11H,5-6H2,1-4H3

InChIKey

DVEACQFCGKZRJO-UHFFFAOYSA-N

Compound name

1-[(2-hydroxy-2-methylpropyl)amino]-2-methylpropan-2-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 58
Patents: 161.14159 Da
Monoisotopic Mass: -0.3
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]+	162.14887	139.0
[M+Na]+	184.13081	144.5
[M-H]-	160.13431	136.5
[M+NH4]+	179.17541	158.4
[M+K]+	200.10475	143.6
[M+H-H2O]+	144.13885	135.3
[M+HCOO]-	206.13979	157.4
[M+CH3COO]-	220.15544	177.6
[M+Na-2H]-	182.11626	145.6
[M]+	161.14104	138.2
[M]-	161.14214	138.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe