CID 99724332

1354351-70-4

Structural Information

Molecular Formula
C7H11ClO2S
SMILES
C1C[C@@H]2C[C@H]1C[C@H]2S(=O)(=O)Cl
InChI
InChI=1S/C7H11ClO2S/c8-11(9,10)7-4-5-1-2-6(7)3-5/h5-7H,1-4H2/t5-,6+,7+/m0/s1
InChIKey
LUQXFQXMGLMKEQ-RRKCRQDMSA-N
Compound name
(1R,2R,4S)-bicyclo[2.2.1]heptane-2-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.01683 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.02411 143.9
[M+Na]+ 217.00605 153.6
[M-H]- 193.00955 147.4
[M+NH4]+ 212.05065 170.1
[M+K]+ 232.97999 150.5
[M+H-H2O]+ 177.01409 142.0
[M+HCOO]- 239.01503 155.4
[M+CH3COO]- 253.03068 177.1
[M+Na-2H]- 214.99150 145.9
[M]+ 194.01628 146.9
[M]- 194.01738 146.9
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.