CID 138040539

2029703-66-8

Structural Information

Molecular Formula
C9H8Cl2O2S
SMILES
C1[C@H]([C@@H]1S(=O)(=O)Cl)C2=CC(=CC=C2)Cl
InChI
InChI=1S/C9H8Cl2O2S/c10-7-3-1-2-6(4-7)8-5-9(8)14(11,12)13/h1-4,8-9H,5H2/t8-,9+/m0/s1
InChIKey
OSJUKSATPIMPLU-DTWKUNHWSA-N
Compound name
(1R,2S)-2-(3-chlorophenyl)cyclopropane-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

249.9622 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.96948 152.4
[M+Na]+ 272.95142 167.7
[M+NH4]+ 267.99602 162.0
[M+K]+ 288.92536 160.0
[M-H]- 248.95492 161.5
[M+Na-2H]- 270.93687 161.6
[M]+ 249.96165 159.3
[M]- 249.96275 159.3
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.