CID 146155894

2416229-18-8

Structural Information

Molecular Formula
C8H13ClO3S
SMILES
C1CC2(CCC1OC2)CS(=O)(=O)Cl
InChI
InChI=1S/C8H13ClO3S/c9-13(10,11)6-8-3-1-7(2-4-8)12-5-8/h7H,1-6H2
InChIKey
CGTJZMHHRQFZLQ-UHFFFAOYSA-N
Compound name
2-oxabicyclo[2.2.2]octan-4-ylmethanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.02739 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.03467 143.6
[M+Na]+ 247.01661 149.7
[M-H]- 223.02011 141.0
[M+NH4]+ 242.06121 168.2
[M+K]+ 262.99055 148.5
[M+H-H2O]+ 207.02465 141.9
[M+HCOO]- 269.02559 145.5
[M+CH3COO]- 283.04124 154.5
[M+Na-2H]- 245.00206 157.0
[M]+ 224.02684 150.3
[M]- 224.02794 150.3
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.