CID 116834

(4-(phenylsulfonyl)phenyl)hydrazine

Structural Information

Molecular Formula
C12H12N2O2S
SMILES
C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)NN
InChI
InChI=1S/C12H12N2O2S/c13-14-10-6-8-12(9-7-10)17(15,16)11-4-2-1-3-5-11/h1-9,14H,13H2
InChIKey
TUJNVZMPIUFYFR-UHFFFAOYSA-N
Compound name
[4-(benzenesulfonyl)phenyl]hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

43
Patents

248.06195 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.06923 151.9
[M+Na]+ 271.05117 159.6
[M-H]- 247.05467 158.5
[M+NH4]+ 266.09577 168.5
[M+K]+ 287.02511 154.8
[M+H-H2O]+ 231.05921 144.7
[M+HCOO]- 293.06015 172.4
[M+CH3COO]- 307.07580 193.1
[M+Na-2H]- 269.03662 158.1
[M]+ 248.06140 151.3
[M]- 248.06250 151.3
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