CID 3047483

Perimidine, 1-(2-(diethylamino)ethyl)-2-(o-methoxyphenyl)-

Structural Information

Molecular Formula

C₂₄H₂₇N₃O

SMILES

CCN(CC)CCN1C2=CC=CC3=C2C(=CC=C3)N=C1C4=CC=CC=C4OC

InChI

InChI=1S/C24H27N3O/c1-4-26(5-2)16-17-27-21-14-9-11-18-10-8-13-20(23(18)21)25-24(27)19-12-6-7-15-22(19)28-3/h6-15H,4-5,16-17H2,1-3H3

InChIKey

CUSFZAPIEVIFIQ-UHFFFAOYSA-N

Compound name

N,N-diethyl-2-[2-(2-methoxyphenyl)perimidin-1-yl]ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 373.21542 Da
Monoisotopic Mass: 4.6
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]+	374.222696	195.6
[M+Na]+	396.204638	201.8
[M-H]-	372.208144	200.9
[M+NH4]+	391.249243	207.2
[M+K]+	412.178578	196.0
[M+H-H2O]+	356.212680	183.4
[M+HCOO]-	418.213621	213.1
[M+CH3COO]-	432.229271	204.3
[M+Na-2H]-	394.190086	200.4
[M]+	373.21487142	199.8
[M]-	373.21596858	199.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.