CID 115021592

(1-methoxycyclobutyl)methanesulfonyl chloride

Structural Information

Molecular Formula
C6H11ClO3S
SMILES
COC1(CCC1)CS(=O)(=O)Cl
InChI
InChI=1S/C6H11ClO3S/c1-10-6(3-2-4-6)5-11(7,8)9/h2-5H2,1H3
InChIKey
CARQNAUGLGWZPA-UHFFFAOYSA-N
Compound name
(1-methoxycyclobutyl)methanesulfonyl 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]+ 199.01903 129.5
[M+Na]+ 221.00097 136.5
[M-H]- 197.00447 133.2
[M+NH4]+ 216.04557 145.4
[M+K]+ 236.97491 137.0
[M+H-H2O]+ 181.00901 121.7
[M+HCOO]- 243.00995 141.5
[M+CH3COO]- 257.02560 180.5
[M+Na-2H]- 218.98642 135.1
[M]+ 198.01120 142.8
[M]- 198.01230 142.8
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.