CID 104548568

3-methoxycyclobutane-1-sulfonyl chloride

Structural Information

Molecular Formula
C5H9ClO3S
SMILES
COC1CC(C1)S(=O)(=O)Cl
InChI
InChI=1S/C5H9ClO3S/c1-9-4-2-5(3-4)10(6,7)8/h4-5H,2-3H2,1H3
InChIKey
ARMXMIZENNFZFC-UHFFFAOYSA-N
Compound name
3-methoxycyclobutane-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.9961 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.00338 124.1
[M+Na]+ 206.98532 131.6
[M-H]- 182.98882 128.0
[M+NH4]+ 202.02992 138.9
[M+K]+ 222.95926 132.3
[M+H-H2O]+ 166.99336 115.3
[M+HCOO]- 228.99430 136.3
[M+CH3COO]- 243.00995 179.1
[M+Na-2H]- 204.97077 128.1
[M]+ 183.99555 137.1
[M]- 183.99665 137.1
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.