CID 76908

3378-72-1

Structural Information

Molecular Formula

C₁₁H₁₇N

SMILES

CC(C)(C)NCC1=CC=CC=C1

InChI

InChI=1S/C11H17N/c1-11(2,3)12-9-10-7-5-4-6-8-10/h4-8,12H,9H2,1-3H3

InChIKey

DLSOILHAKCBARI-UHFFFAOYSA-N

Compound name

N-benzyl-2-methylpropan-2-amine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 5
References: 3304
Patents: 163.1361 Da
Monoisotopic Mass: 2.5
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]+	164.14338	138.1
[M+Na]+	186.12532	150.2
[M+NH4]+	181.16992	147.4
[M+K]+	202.09926	143.2
[M-H]-	162.12882	141.2
[M+Na-2H]-	184.11077	146.0
[M]+	163.13555	140.8
[M]-	163.13665	140.8

Literature stripe

literature stripe

Patent stripe

patents stripe