CID 132398925

Rac-(1r,2r)-1-(methoxymethyl)-2-methylcyclopropane-1-sulfonyl chloride

Structural Information

Molecular Formula
C6H11ClO3S
SMILES
C[C@H]1C[C@]1(COC)S(=O)(=O)Cl
InChI
InChI=1S/C6H11ClO3S/c1-5-3-6(5,4-10-2)11(7,8)9/h5H,3-4H2,1-2H3/t5-,6+/m0/s1
InChIKey
JSRZGBQHGYSMSG-NTSWFWBYSA-N
Compound name
trans-(1S,2S)-1-(methoxymethyl)-2-methylcyclopropane-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.01175 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.019026 133.6
[M+Na]+ 221.000968 144.7
[M-H]- 197.004474 138.9
[M+NH4]+ 216.045573 151.5
[M+K]+ 236.974908 141.9
[M+H-H2O]+ 181.009010 130.6
[M+HCOO]- 243.009951 147.1
[M+CH3COO]- 257.025601 182.0
[M+Na-2H]- 218.986416 139.1
[M]+ 198.01120142 142.7
[M]- 198.01229858 142.7
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.