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

48
Patents

248.06195 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.069226 151.9
[M+Na]+ 271.051168 159.6
[M-H]- 247.054674 158.5
[M+NH4]+ 266.095773 168.5
[M+K]+ 287.025108 154.8
[M+H-H2O]+ 231.059210 144.7
[M+HCOO]- 293.060151 172.4
[M+CH3COO]- 307.075801 193.1
[M+Na-2H]- 269.036616 158.1
[M]+ 248.06140142 151.3
[M]- 248.06249858 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