CID 98601

N-tert-butyldibenzylamine

Structural Information

Molecular Formula

C₁₈H₂₃N

SMILES

CC(C)(C)N(CC1=CC=CC=C1)CC2=CC=CC=C2

InChI

InChI=1S/C18H23N/c1-18(2,3)19(14-16-10-6-4-7-11-16)15-17-12-8-5-9-13-17/h4-13H,14-15H2,1-3H3

InChIKey

PPFYOXKDKHANSL-UHFFFAOYSA-N

Compound name

N,N-dibenzyl-2-methylpropan-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 106
Patents: 253.18304 Da
Monoisotopic Mass: 4.2
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]+	254.190316	162.1
[M+Na]+	276.172258	166.9
[M-H]-	252.175764	169.5
[M+NH4]+	271.216863	179.3
[M+K]+	292.146198	163.8
[M+H-H2O]+	236.180300	154.2
[M+HCOO]-	298.181241	185.1
[M+CH3COO]-	312.196891	202.1
[M+Na-2H]-	274.157706	168.3
[M]+	253.18249142	162.6
[M]-	253.18358858	162.6

Literature stripe

literature stripe

Patent stripe

patents stripe