CID 2390001

{4-[4-(propan-2-yl)benzenesulfonyl]phenyl}hydrazine

Structural Information

Molecular Formula
C15H18N2O2S
SMILES
CC(C)C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)NN
InChI
InChI=1S/C15H18N2O2S/c1-11(2)12-3-7-14(8-4-12)20(18,19)15-9-5-13(17-16)6-10-15/h3-11,17H,16H2,1-2H3
InChIKey
IULNVWCMNWGYSH-UHFFFAOYSA-N
Compound name
[4-(4-propan-2-ylphenyl)sulfonylphenyl]hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

0
Patents

290.1089 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.116176 165.3
[M+Na]+ 313.098118 172.2
[M-H]- 289.101624 171.7
[M+NH4]+ 308.142723 180.4
[M+K]+ 329.072058 167.3
[M+H-H2O]+ 273.106160 157.8
[M+HCOO]- 335.107101 183.7
[M+CH3COO]- 349.122751 204.2
[M+Na-2H]- 311.083566 168.3
[M]+ 290.10835142 165.6
[M]- 290.10944858 165.6
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

No patent data available for this compound.