CID 137935937

2253641-27-7

Structural Information

Molecular Formula
C7H10ClFO2S
SMILES
C1C(CC12CC2F)CS(=O)(=O)Cl
InChI
InChI=1S/C7H10ClFO2S/c8-12(10,11)4-5-1-7(2-5)3-6(7)9/h5-6H,1-4H2
InChIKey
XHEDJCFUFVZBLG-UHFFFAOYSA-N
Compound name
(2-fluorospiro[2.3]hexan-5-yl)methanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.0074 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.01468 127.2
[M+Na]+ 234.99662 136.4
[M-H]- 211.00012 132.4
[M+NH4]+ 230.04122 138.5
[M+K]+ 250.97056 135.5
[M+H-H2O]+ 195.00466 118.3
[M+HCOO]- 257.00560 137.7
[M+CH3COO]- 271.02125 187.2
[M+Na-2H]- 232.98207 132.2
[M]+ 212.00685 140.1
[M]- 212.00795 140.1
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.