CID 138989246

(1-methylcyclopropyl)methanesulfonyl fluoride

Structural Information

Molecular Formula
C5H9FO2S
SMILES
CC1(CC1)CS(=O)(=O)F
InChI
InChI=1S/C5H9FO2S/c1-5(2-3-5)4-9(6,7)8/h2-4H2,1H3
InChIKey
LQNNKIZQFLCUKJ-UHFFFAOYSA-N
Compound name
(1-methylcyclopropyl)methanesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.03073 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.038006 124.7
[M+Na]+ 175.019948 135.2
[M-H]- 151.023454 128.6
[M+NH4]+ 170.064553 143.3
[M+K]+ 190.993888 133.8
[M+H-H2O]+ 135.027990 119.7
[M+HCOO]- 197.028931 141.7
[M+CH3COO]- 211.044581 175.0
[M+Na-2H]- 173.005396 130.9
[M]+ 152.03018142 129.1
[M]- 152.03127858 129.1
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.