CID 3022314

93777-87-8

Structural Information

Molecular Formula

C₁₁H₁₆N₂

SMILES

CC1=CC=CC=C1N=C(C)N(C)C

InChI

InChI=1S/C11H16N2/c1-9-7-5-6-8-11(9)12-10(2)13(3)4/h5-8H,1-4H3

InChIKey

UENINLIJIFKGHL-UHFFFAOYSA-N

Compound name

N,N-dimethyl-N'-(2-methylphenyl)ethanimidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 176.13135 Da
Monoisotopic Mass: 1.9
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]+	177.138626	140.1
[M+Na]+	199.120568	146.7
[M-H]-	175.124074	146.7
[M+NH4]+	194.165173	161.4
[M+K]+	215.094508	146.5
[M+H-H2O]+	159.128610	133.4
[M+HCOO]-	221.129551	167.3
[M+CH3COO]-	235.145201	193.0
[M+Na-2H]-	197.106016	145.6
[M]+	176.13080142	141.3
[M]-	176.13189858	141.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe