CID 16206854

Trioxirane

Structural Information

Molecular Formula

O₃

SMILES

O1OO1

InChI

InChI=1S/O3/c1-2-3-1

InChIKey

XQOAKYYZMDCSIA-UHFFFAOYSA-N

Compound name

trioxirane

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 0
References: 196765
Patents: 47.984745 Da
Monoisotopic Mass: 0.1
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]+	48.992021	101.2
[M+Na]+	70.973963	113.1
[M-H]-	46.977469	108.9
[M+NH4]+	66.018568	117.8
[M+K]+	86.947903	117.5
[M+H-H2O]+	30.982005	95.7
[M+HCOO]-	92.982946	126.0
[M+CH3COO]-	106.998596	157.0
[M+Na-2H]-	68.959411	116.3
[M]+	47.98419642	108.5
[M]-	47.98529358	108.5

Literature stripe

literature stripe

Patent stripe

patents stripe