CID 132343979

2138027-71-9

Structural Information

Molecular Formula
C7H11ClO2S
SMILES
C1CC2CC(C2C1)S(=O)(=O)Cl
InChI
InChI=1S/C7H11ClO2S/c8-11(9,10)7-4-5-2-1-3-6(5)7/h5-7H,1-4H2
InChIKey
BJQOVKRPWVEMSK-UHFFFAOYSA-N
Compound name
bicyclo[3.2.0]heptane-6-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.01683 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.02411 129.9
[M+Na]+ 217.00605 137.4
[M-H]- 193.00955 134.4
[M+NH4]+ 212.05065 147.1
[M+K]+ 232.97999 137.0
[M+H-H2O]+ 177.01409 122.0
[M+HCOO]- 239.01503 140.7
[M+CH3COO]- 253.03068 180.9
[M+Na-2H]- 214.99150 133.1
[M]+ 194.01628 140.8
[M]- 194.01738 140.8
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.