CID 138989254

2138217-83-9

Structural Information

Molecular Formula
C7H13FO2S
SMILES
CC1(CC(C1)CS(=O)(=O)F)C
InChI
InChI=1S/C7H13FO2S/c1-7(2)3-6(4-7)5-11(8,9)10/h6H,3-5H2,1-2H3
InChIKey
QNMQIMYVXLUDMQ-UHFFFAOYSA-N
Compound name
(3,3-dimethylcyclobutyl)methanesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

180.06203 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.069306 131.2
[M+Na]+ 203.051248 138.0
[M-H]- 179.054754 133.8
[M+NH4]+ 198.095853 147.2
[M+K]+ 219.025188 139.4
[M+H-H2O]+ 163.059290 121.6
[M+HCOO]- 225.060231 145.7
[M+CH3COO]- 239.075881 181.5
[M+Na-2H]- 201.036696 134.9
[M]+ 180.06148142 141.1
[M]- 180.06257858 141.1
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.