CID 82275279

2361678-81-9

Structural Information

Molecular Formula

C₁₀H₁₃NO

SMILES

C1CC1(CO)C2=CC=C(C=C2)N

InChI

InChI=1S/C10H13NO/c11-9-3-1-8(2-4-9)10(7-12)5-6-10/h1-4,12H,5-7,11H2

InChIKey

GKJDRRCZPHCTJA-UHFFFAOYSA-N

Compound name

[1-(4-aminophenyl)cyclopropyl]methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 163.09972 Da
Monoisotopic Mass: 1.1
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]+	164.10700	136.3
[M+Na]+	186.08894	149.8
[M+NH4]+	181.13354	147.2
[M+K]+	202.06288	143.1
[M-H]-	162.09244	147.2
[M+Na-2H]-	184.07439	147.9
[M]+	163.09917	142.6
[M]-	163.10027	142.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.