CID 93179

2,6-diethyl-n-methyleneaniline

Structural Information

Molecular Formula

C₁₁H₁₅N

SMILES

CCC1=C(C(=CC=C1)CC)N=C

InChI

InChI=1S/C11H15N/c1-4-9-7-6-8-10(5-2)11(9)12-3/h6-8H,3-5H2,1-2H3

InChIKey

ZMBSRNHDTFKMLI-UHFFFAOYSA-N

Compound name

N-(2,6-diethylphenyl)methanimine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 37
Patents: 161.12045 Da
Monoisotopic Mass: 4.5
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]+	162.12773	135.5
[M+Na]+	184.10967	149.2
[M+NH4]+	179.15427	145.1
[M+K]+	200.08361	141.0
[M-H]-	160.11317	139.6
[M+Na-2H]-	182.09512	143.6
[M]+	161.11990	138.7
[M]-	161.12100	138.7

Literature stripe

literature stripe

Patent stripe

patents stripe