CID 57494570

1036647-63-8

Structural Information

Molecular Formula

C₁₁H₁₄N₄O

SMILES

C1COCCN1C2=CC=CC3=C2C(=NN3)N

InChI

InChI=1S/C11H14N4O/c12-11-10-8(13-14-11)2-1-3-9(10)15-4-6-16-7-5-15/h1-3H,4-7H2,(H3,12,13,14)

InChIKey

MTUHEFSYPUASJZ-UHFFFAOYSA-N

Compound name

4-morpholin-4-yl-1H-indazol-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 18
Patents: 218.11676 Da
Monoisotopic Mass: 1.0
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]+	219.12404	146.9
[M+Na]+	241.10598	154.9
[M-H]-	217.10948	149.4
[M+NH4]+	236.15058	161.4
[M+K]+	257.07992	151.1
[M+H-H2O]+	201.11402	138.0
[M+HCOO]-	263.11496	164.2
[M+CH3COO]-	277.13061	158.2
[M+Na-2H]-	239.09143	152.9
[M]+	218.11621	142.6
[M]-	218.11731	142.6

Literature stripe

literature stripe

Patent stripe

patents stripe