CID 155943662

2613385-93-4

Structural Information

Molecular Formula
C9H15ClO3S
SMILES
C1CC2CCC(OC2C1)CS(=O)(=O)Cl
InChI
InChI=1S/C9H15ClO3S/c10-14(11,12)6-8-5-4-7-2-1-3-9(7)13-8/h7-9H,1-6H2
InChIKey
XRAMMOUXJIUFMH-UHFFFAOYSA-N
Compound name
2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyran-2-ylmethanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.04305 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.05033 148.9
[M+Na]+ 261.03227 158.3
[M+NH4]+ 256.07687 157.8
[M+K]+ 277.00621 152.9
[M-H]- 237.03577 150.6
[M+Na-2H]- 259.01772 150.6
[M]+ 238.04250 151.3
[M]- 238.04360 151.3
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.