CID 152214

1-phenylcyclobutylamine

Structural Information

Molecular Formula

C₁₀H₁₃N

SMILES

C1CC(C1)(C2=CC=CC=C2)N

InChI

InChI=1S/C10H13N/c11-10(7-4-8-10)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8,11H2

InChIKey

OZJAIRCFCMQFIF-UHFFFAOYSA-N

Compound name

1-phenylcyclobutan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 283
Patents: 147.1048 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]+	148.11208	130.5
[M+Na]+	170.09402	138.4
[M+NH4]+	165.13862	137.9
[M+K]+	186.06796	131.6
[M-H]-	146.09752	132.7
[M+Na-2H]-	168.07947	138.3
[M]+	147.10425	131.2
[M]-	147.10535	131.2

Literature stripe

literature stripe

Patent stripe

patents stripe