CID 215737

36173-91-8

Structural Information

Molecular Formula

C₁₃H₁₇N₃O₂

SMILES

C1COCCN1CCOC2=NNC3=CC=CC=C32

InChI

InChI=1S/C13H17N3O2/c1-2-4-12-11(3-1)13(15-14-12)18-10-7-16-5-8-17-9-6-16/h1-4H,5-10H2,(H,14,15)

InChIKey

IVBQJVHHNINBEC-UHFFFAOYSA-N

Compound name

4-[2-(1H-indazol-3-yloxy)ethyl]morpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 14
Patents: 247.13208 Da
Monoisotopic Mass: 1.5
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]+	248.13936	154.3
[M+Na]+	270.12130	161.0
[M-H]-	246.12480	156.4
[M+NH4]+	265.16590	167.7
[M+K]+	286.09524	157.9
[M+H-H2O]+	230.12934	144.8
[M+HCOO]-	292.13028	170.6
[M+CH3COO]-	306.14593	164.9
[M+Na-2H]-	268.10675	160.3
[M]+	247.13153	153.1
[M]-	247.13263	153.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe