CID 155978486

[3,3-difluoro-1-(methoxymethyl)cyclobutyl]methanesulfonyl chloride

Structural Information

Molecular Formula
C7H11ClF2O3S
SMILES
COCC1(CC(C1)(F)F)CS(=O)(=O)Cl
InChI
InChI=1S/C7H11ClF2O3S/c1-13-4-6(5-14(8,11)12)2-7(9,10)3-6/h2-5H2,1H3
InChIKey
VIZQHBLLNNBEJM-UHFFFAOYSA-N
Compound name
[3,3-difluoro-1-(methoxymethyl)cyclobutyl]methanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

248.00854 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.015816 137.3
[M+Na]+ 270.997758 145.3
[M-H]- 247.001264 138.7
[M+NH4]+ 266.042363 153.2
[M+K]+ 286.971698 145.0
[M+H-H2O]+ 231.005800 129.3
[M+HCOO]- 293.006741 146.9
[M+CH3COO]- 307.022391 189.5
[M+Na-2H]- 268.983206 142.4
[M]+ 248.00799142 149.5
[M]- 248.00908858 149.5
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.