CID 138040564

2243503-67-3

Structural Information

Molecular Formula
C8H14ClNO4S
SMILES
CC(=O)OCC1CCN(CC1)S(=O)(=O)Cl
InChI
InChI=1S/C8H14ClNO4S/c1-7(11)14-6-8-2-4-10(5-3-8)15(9,12)13/h8H,2-6H2,1H3
InChIKey
XEQLPYVOLBXMJN-UHFFFAOYSA-N
Compound name
(1-chlorosulfonylpiperidin-4-yl)methyl acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.0332 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.04048 152.8
[M+Na]+ 278.02242 161.9
[M+NH4]+ 273.06702 159.1
[M+K]+ 293.99636 156.1
[M-H]- 254.02592 151.3
[M+Na-2H]- 276.00787 155.0
[M]+ 255.03265 154.0
[M]- 255.03375 154.0
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.