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

45
Patents

171.01656 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.02384 123.1
[M+Na]+ 194.00578 132.7
[M-H]- 170.00928 124.9
[M+NH4]+ 189.05038 140.0
[M+K]+ 209.97972 130.6
[M+H-H2O]+ 154.01382 117.1
[M+HCOO]- 216.01476 138.6
[M+CH3COO]- 230.03041 179.4
[M+Na-2H]- 191.99123 127.8
[M]+ 171.01601 123.6
[M]- 171.01711 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