CID 98469853

1909287-43-9

Structural Information

Molecular Formula
C9H9ClO2S
SMILES
C1[C@H]([C@@H]1S(=O)(=O)Cl)C2=CC=CC=C2
InChI
InChI=1S/C9H9ClO2S/c10-13(11,12)9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6H2/t8-,9+/m0/s1
InChIKey
FEPOIQPPYDWSBG-DTWKUNHWSA-N
Compound name
(1R,2S)-2-phenylcyclopropane-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.00117 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.00845 136.4
[M+Na]+ 238.99039 147.5
[M-H]- 214.99389 144.5
[M+NH4]+ 234.03499 151.7
[M+K]+ 254.96433 142.9
[M+H-H2O]+ 198.99843 131.2
[M+HCOO]- 260.99937 151.2
[M+CH3COO]- 275.01502 184.7
[M+Na-2H]- 236.97584 141.6
[M]+ 216.00062 142.5
[M]- 216.00172 142.5
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.