CID 11008251

1-(3-methoxyphenyl)cyclopropan-1-amine hydrochloride

Structural Information

Molecular Formula

C₁₀H₁₃NO

SMILES

COC1=CC=CC(=C1)C2(CC2)N

InChI

InChI=1S/C10H13NO/c1-12-9-4-2-3-8(7-9)10(11)5-6-10/h2-4,7H,5-6,11H2,1H3

InChIKey

QOUFBHVWPGAWAG-UHFFFAOYSA-N

Compound name

1-(3-methoxyphenyl)cyclopropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 72
Patents: 163.09972 Da
Monoisotopic Mass: 1.5
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]+	164.10700	136.4
[M+Na]+	186.08894	150.3
[M+NH4]+	181.13354	147.6
[M+K]+	202.06288	143.4
[M-H]-	162.09244	147.7
[M+Na-2H]-	184.07439	148.5
[M]+	163.09917	142.9
[M]-	163.10027	142.9

Literature stripe

literature stripe

Patent stripe

patents stripe