CID 215750

Ethanamine, n,n-dimethyl-2-(1h-indazol-5-yloxy)-, dihydrochloride

Structural Information

Molecular Formula

C₁₁H₁₅N₃O

SMILES

CN(C)CCOC1=CC2=C(C=C1)NN=C2

InChI

InChI=1S/C11H15N3O/c1-14(2)5-6-15-10-3-4-11-9(7-10)8-12-13-11/h3-4,7-8H,5-6H2,1-2H3,(H,12,13)

InChIKey

JGZBCZZWHRVVSM-UHFFFAOYSA-N

Compound name

2-(1H-indazol-5-yloxy)-N,N-dimethylethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 205.1215 Da
Monoisotopic Mass: 2.2
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]+	206.128776	144.1
[M+Na]+	228.110718	152.8
[M-H]-	204.114224	146.4
[M+NH4]+	223.155323	163.2
[M+K]+	244.084658	150.3
[M+H-H2O]+	188.118760	136.3
[M+HCOO]-	250.119701	167.8
[M+CH3COO]-	264.135351	188.7
[M+Na-2H]-	226.096166	151.5
[M]+	205.12095142	147.3
[M]-	205.12204858	147.3

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.