CID 691368

75908-78-0

Structural Information

Molecular Formula

C₁₇H₂₀N₂

SMILES

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

InChI

InChI=1S/C17H20N2/c1-13-5-8-16(11-14(13)2)18-12-15-6-9-17(10-7-15)19(3)4/h5-12H,1-4H3

InChIKey

HDROJFNYZIYFFQ-UHFFFAOYSA-N

Compound name

4-[(3,4-dimethylphenyl)iminomethyl]-N,N-dimethylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 6
References: 1
Patents: 252.16264 Da
Monoisotopic Mass: 4.1
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	160.0
[M+Na]+	275.151858	167.4
[M-H]-	251.155364	169.7
[M+NH4]+	270.196463	178.3
[M+K]+	291.125798	164.4
[M+H-H2O]+	235.159900	151.6
[M+HCOO]-	297.160841	187.6
[M+CH3COO]-	311.176491	208.8
[M+Na-2H]-	273.137306	164.7
[M]+	252.16209142	162.3
[M]-	252.16318858	162.3

Literature stripe

literature stripe

Patent stripe

patents stripe