CID 2756630

76122-58-2

Structural Information

Molecular Formula

C₁₅H₁₇N

SMILES

CC1=CC=CC=C1CNCC2=CC=CC=C2

InChI

InChI=1S/C15H17N/c1-13-7-5-6-10-15(13)12-16-11-14-8-3-2-4-9-14/h2-10,16H,11-12H2,1H3

InChIKey

QSBDXBZYSGBRBS-UHFFFAOYSA-N

Compound name

N-[(2-methylphenyl)methyl]-1-phenylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 15
Patents: 211.1361 Da
Monoisotopic Mass: 3.1
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]+	212.14338	149.6
[M+Na]+	234.12532	164.6
[M+NH4]+	229.16992	159.7
[M+K]+	250.09926	155.1
[M-H]-	210.12882	156.1
[M+Na-2H]-	232.11077	160.6
[M]+	211.13555	153.8
[M]-	211.13665	153.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe