CID 10953823

[cyclopropyl(phenyl)methyl](methyl)amine

Structural Information

Molecular Formula

C₁₁H₁₅N

SMILES

CNC(C1CC1)C2=CC=CC=C2

InChI

InChI=1S/C11H15N/c1-12-11(10-7-8-10)9-5-3-2-4-6-9/h2-6,10-12H,7-8H2,1H3

InChIKey

JDUBUKLTCBRTES-UHFFFAOYSA-N

Compound name

1-cyclopropyl-N-methyl-1-phenylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 161.12045 Da
Monoisotopic Mass: 2.1
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]+	162.12773	136.5
[M+Na]+	184.10967	150.0
[M+NH4]+	179.15427	146.7
[M+K]+	200.08361	144.4
[M-H]-	160.11317	148.0
[M+Na-2H]-	182.09512	147.7
[M]+	161.11990	142.8
[M]-	161.12100	142.8

Literature stripe

literature stripe

Patent stripe

patents stripe