CID 391184

Ns00073637

Structural Information

Molecular Formula

SMILES

O[Cl+3](O)(O)O

InChI

InChI=1S/ClH4O4/c2-1(3,4)5/h2-5H/q+3

InChIKey

DSCIAMSSIWISLA-UHFFFAOYSA-N

Compound name

None

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 102.97981 Da
Monoisotopic Mass: -1.1
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]+	103.987086	109.0
[M+Na]+	125.969028	118.0
[M-H]-	101.972534	105.1
[M+NH4]+	121.013633	130.0
[M+K]+	141.942968	110.4
[M+H-H2O]+	85.977070	110.7
[M+HCOO]-	147.978011	123.5
[M+CH3COO]-	161.993661	143.9
[M+Na-2H]-	123.954476	120.1
[M]+	102.97926142	106.2
[M]-	102.98035858	106.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.