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

3
Patents

183.9961 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.003376 124.1
[M+Na]+ 206.985318 131.6
[M-H]- 182.988824 128.0
[M+NH4]+ 202.029923 138.9
[M+K]+ 222.959258 132.3
[M+H-H2O]+ 166.993360 115.3
[M+HCOO]- 228.994301 136.3
[M+CH3COO]- 243.009951 179.1
[M+Na-2H]- 204.970766 128.1
[M]+ 183.99555142 137.1
[M]- 183.99664858 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

patents stripe