CID 122164168

1955548-44-3

Structural Information

Molecular Formula

C₅H₉ClO₃S

SMILES

C1C[C@H]([C@@H](C1)S(=O)(=O)Cl)O

InChI

InChI=1S/C5H9ClO3S/c6-10(8,9)5-3-1-2-4(5)7/h4-5,7H,1-3H2/t4-,5-/m1/s1

InChIKey

KDTVEQALNVUIGU-RFZPGFLSSA-N

Compound name

(1R,2R)-2-hydroxycyclopentane-1-sulfonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 16
Patents: 183.9961 Da
Monoisotopic Mass: 1.2
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]+	185.00338	135.9
[M+Na]+	206.98532	145.0
[M+NH4]+	202.02992	143.9
[M+K]+	222.95926	140.6
[M-H]-	182.98882	135.1
[M+Na-2H]-	204.97077	138.4
[M]+	183.99555	137.4
[M]-	183.99665	137.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe