CID 145867655

3-propylcyclobutane-1-sulfonyl chloride

Structural Information

Molecular Formula
C7H13ClO2S
SMILES
CCCC1CC(C1)S(=O)(=O)Cl
InChI
InChI=1S/C7H13ClO2S/c1-2-3-6-4-7(5-6)11(8,9)10/h6-7H,2-5H2,1H3
InChIKey
GPYRQFVWLDOYRK-UHFFFAOYSA-N
Compound name
3-propylcyclobutane-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.03249 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.03977 134.0
[M+Na]+ 219.02171 140.3
[M+NH4]+ 214.06631 138.6
[M+K]+ 234.99565 135.3
[M-H]- 195.02521 131.6
[M+Na-2H]- 217.00716 135.6
[M]+ 196.03194 133.7
[M]- 196.03304 133.7
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.