CID 42117

57058-35-2

Structural Information

Molecular Formula

C₁₇H₂₀N₂

SMILES

CC(=NC(C1=CC=CC=C1)C2=CC=CC=C2)N(C)C

InChI

InChI=1S/C17H20N2/c1-14(19(2)3)18-17(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-13,17H,1-3H3

InChIKey

LONKYVIUVUQARL-UHFFFAOYSA-N

Compound name

N'-benzhydryl-N,N-dimethylethanimidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 252.16264 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]+	253.169916	161.6
[M+Na]+	275.151858	165.5
[M-H]-	251.155364	170.2
[M+NH4]+	270.196463	178.7
[M+K]+	291.125798	163.5
[M+H-H2O]+	235.159900	152.8
[M+HCOO]-	297.160841	187.1
[M+CH3COO]-	311.176491	206.4
[M+Na-2H]-	273.137306	166.0
[M]+	252.16209142	161.3
[M]-	252.16318858	161.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe