CID 730266

(e)-n-(4-fluorophenyl)-2-phenylethenesulfonamide

Structural Information

Molecular Formula
C14H12FNO2S
SMILES
C1=CC=C(C=C1)/C=C/S(=O)(=O)NC2=CC=C(C=C2)F
InChI
InChI=1S/C14H12FNO2S/c15-13-6-8-14(9-7-13)16-19(17,18)11-10-12-4-2-1-3-5-12/h1-11,16H/b11-10+
InChIKey
XMABHOFNENDQOQ-ZHACJKMWSA-N
Compound name
(E)-N-(4-fluorophenyl)-2-phenylethenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

12
Patents

277.05728 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.06456 159.1
[M+Na]+ 300.04650 167.2
[M-H]- 276.05000 164.6
[M+NH4]+ 295.09110 175.1
[M+K]+ 316.02044 161.4
[M+H-H2O]+ 260.05454 150.9
[M+HCOO]- 322.05548 177.7
[M+CH3COO]- 336.07113 195.8
[M+Na-2H]- 298.03195 164.0
[M]+ 277.05673 159.1
[M]- 277.05783 159.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe