CID 68182898

1-(difluoromethyl)cyclopropane-1-sulfonamide

Structural Information

Molecular Formula
C4H7F2NO2S
SMILES
C1CC1(C(F)F)S(=O)(=O)N
InChI
InChI=1S/C4H7F2NO2S/c5-3(6)4(1-2-4)10(7,8)9/h3H,1-2H2,(H2,7,8,9)
InChIKey
FEUBOESFAJMWKP-UHFFFAOYSA-N
Compound name
1-(difluoromethyl)cyclopropane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

43
Patents

171.01656 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.023836 123.1
[M+Na]+ 194.005778 132.7
[M-H]- 170.009284 124.9
[M+NH4]+ 189.050383 140.0
[M+K]+ 209.979718 130.6
[M+H-H2O]+ 154.013820 117.1
[M+HCOO]- 216.014761 138.6
[M+CH3COO]- 230.030411 179.4
[M+Na-2H]- 191.991226 127.8
[M]+ 171.01601142 123.6
[M]- 171.01710858 123.6
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

patents stripe