CID 10560454

Bis(2-methylphenyl)methanamine

Structural Information

Molecular Formula

C₁₅H₁₇N

SMILES

CC1=CC=CC=C1C(C2=CC=CC=C2C)N

InChI

InChI=1S/C15H17N/c1-11-7-3-5-9-13(11)15(16)14-10-6-4-8-12(14)2/h3-10,15H,16H2,1-2H3

InChIKey

PDPZUUCRTFJFOZ-UHFFFAOYSA-N

Compound name

bis(2-methylphenyl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 50
Patents: 211.1361 Da
Monoisotopic Mass: 3.2
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	164.3
[M+NH4]+	229.16992	159.4
[M+K]+	250.09926	156.1
[M-H]-	210.12882	155.8
[M+Na-2H]-	232.11077	159.6
[M]+	211.13555	153.6
[M]-	211.13665	153.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe