CID 102896301

{1-oxaspiro[4.4]nonan-2-yl}methanesulfonyl chloride

Structural Information

Molecular Formula
C9H15ClO3S
SMILES
C1CCC2(C1)CCC(O2)CS(=O)(=O)Cl
InChI
InChI=1S/C9H15ClO3S/c10-14(11,12)7-8-3-6-9(13-8)4-1-2-5-9/h8H,1-7H2
InChIKey
UOTWCQDVUAUMMS-UHFFFAOYSA-N
Compound name
1-oxaspiro[4.4]nonan-2-ylmethanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.04305 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.05033 150.5
[M+Na]+ 261.03227 158.6
[M+NH4]+ 256.07687 160.4
[M+K]+ 277.00621 153.6
[M-H]- 237.03577 152.2
[M+Na-2H]- 259.01772 154.1
[M]+ 238.04250 152.8
[M]- 238.04360 152.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.