CID 658645

3-aminoadamantan-1-ol

Structural Information

Molecular Formula

C₁₀H₁₇NO

SMILES

C1C2CC3(CC1CC(C2)(C3)O)N

InChI

InChI=1S/C10H17NO/c11-9-2-7-1-8(3-9)5-10(12,4-7)6-9/h7-8,12H,1-6,11H2

InChIKey

DWPIPTNBOVJYAD-UHFFFAOYSA-N

Compound name

3-aminoadamantan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 900
Patents: 167.13101 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]+	168.13829	138.2
[M+Na]+	190.12023	146.5
[M+NH4]+	185.16483	152.6
[M+K]+	206.09417	136.0
[M-H]-	166.12373	136.6
[M+Na-2H]-	188.10568	137.0
[M]+	167.13046	139.1
[M]-	167.13156	139.1

Literature stripe

literature stripe

Patent stripe

patents stripe