CID 16986

Nsc665668

Structural Information

Molecular Formula

C₁₃H₁₅N₃O

SMILES

CN(C)C=NC1=C2C(=CC(=C1)OC)C=CC=N2

InChI

InChI=1S/C13H15N3O/c1-16(2)9-15-12-8-11(17-3)7-10-5-4-6-14-13(10)12/h4-9H,1-3H3

InChIKey

BUXTWLVXBUNDQZ-UHFFFAOYSA-N

Compound name

N'-(6-methoxyquinolin-8-yl)-N,N-dimethylmethanimidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 229.1215 Da
Monoisotopic Mass: 1.7
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]+	230.12878	150.9
[M+Na]+	252.11072	164.4
[M+NH4]+	247.15532	159.7
[M+K]+	268.08466	156.8
[M-H]-	228.11422	155.2
[M+Na-2H]-	250.09617	159.0
[M]+	229.12095	154.0
[M]-	229.12205	154.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe