CID 22187

5897-76-7

Structural Information

Molecular Formula

C₁₀H₁₅NO

SMILES

CCC(C(C1=CC=CC=C1)O)N

InChI

InChI=1S/C10H15NO/c1-2-9(11)10(12)8-6-4-3-5-7-8/h3-7,9-10,12H,2,11H2,1H3

InChIKey

UOZNVPFVNBRISY-UHFFFAOYSA-N

Compound name

2-amino-1-phenylbutan-1-ol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 105
Patents: 165.11537 Da
Monoisotopic Mass: 1.4
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]+	166.12265	137.4
[M+Na]+	188.10459	147.9
[M+NH4]+	183.14919	145.6
[M+K]+	204.07853	142.6
[M-H]-	164.10809	139.4
[M+Na-2H]-	186.09004	143.3
[M]+	165.11482	139.2
[M]-	165.11592	139.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe