CID 72214433

Oxetane-3-sulfonyl chloride

Structural Information

Molecular Formula

C₃H₅ClO₃S

SMILES

C1C(CO1)S(=O)(=O)Cl

InChI

InChI=1S/C3H5ClO3S/c4-8(5,6)3-1-7-2-3/h3H,1-2H2

InChIKey

QCQMLRRDOKKVFL-UHFFFAOYSA-N

Compound name

oxetane-3-sulfonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 140
Patents: 155.9648 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]+	156.97208	119.2
[M+Na]+	178.95402	125.7
[M+NH4]+	173.99862	123.7
[M+K]+	194.92796	122.3
[M-H]-	154.95752	117.6
[M+Na-2H]-	176.93947	121.2
[M]+	155.96425	119.1
[M]-	155.96535	119.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe