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

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	181.06931	137.8
[M+Na]+	203.05125	142.4
[M+NH4]+	198.09585	142.6
[M+K]+	219.02519	136.4
[M-H]-	179.05475	133.8
[M+Na-2H]-	201.03670	139.8
[M]+	180.06148	136.6
[M]-	180.06258	136.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.