CID 130657266

3,3-difluorobutane-1-sulfonamide

Structural Information

Molecular Formula
C4H9F2NO2S
SMILES
CC(CCS(=O)(=O)N)(F)F
InChI
InChI=1S/C4H9F2NO2S/c1-4(5,6)2-3-10(7,8)9/h2-3H2,1H3,(H2,7,8,9)
InChIKey
QLXUDXZGKDHONH-UHFFFAOYSA-N
Compound name
3,3-difluorobutane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

173.03221 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.03949 130.2
[M+Na]+ 196.02143 138.4
[M-H]- 172.02493 127.7
[M+NH4]+ 191.06603 150.3
[M+K]+ 211.99537 136.5
[M+H-H2O]+ 156.02947 124.1
[M+HCOO]- 218.03041 145.0
[M+CH3COO]- 232.04606 177.5
[M+Na-2H]- 194.00688 134.3
[M]+ 173.03166 128.8
[M]- 173.03276 128.8
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