CID 62395

Zirconia

Structural Information

Molecular Formula

SMILES

O=[Zr]=O

InChI

InChI=1S/2O.Zr

InChIKey

MCMNRKCIXSYSNV-UHFFFAOYSA-N

Compound name

dioxozirconium

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 6312
References: 155610
Patents: 121.89453 Da
Monoisotopic Mass: None
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]+	122.90181	111.9
[M+Na]+	144.88375	123.3
[M+NH4]+	139.92835	120.1
[M+K]+	160.85769	117.8
[M-H]-	120.88725	111.1
[M+Na-2H]-	142.86920	116.4
[M]+	121.89398	113.0
[M]-	121.89508	113.0

Literature stripe

literature stripe

Patent stripe

patents stripe