CID 226842

72622-74-3

Structural Information

Molecular Formula

C₈H₂₀N₂O

SMILES

CC(C)(CNC(C)(C)CO)N

InChI

InChI=1S/C8H20N2O/c1-7(2,9)5-10-8(3,4)6-11/h10-11H,5-6,9H2,1-4H3

InChIKey

KELFTKQGPKSTJH-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 45
Patents: 160.15756 Da
Monoisotopic Mass: -0.6
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]+	161.16484	138.3
[M+Na]+	183.14678	144.9
[M+NH4]+	178.19138	144.8
[M+K]+	199.12072	141.9
[M-H]-	159.15028	136.8
[M+Na-2H]-	181.13223	140.5
[M]+	160.15701	138.5
[M]-	160.15811	138.5

Literature stripe

literature stripe

Patent stripe

patents stripe