CID 9592522

N'-(4-butoxybenzylidene)-4-methylbenzenesulfonohydrazide

Structural Information

Molecular Formula
C18H22N2O3S
SMILES
CCCCOC1=CC=C(C=C1)/C=N/NS(=O)(=O)C2=CC=C(C=C2)C
InChI
InChI=1S/C18H22N2O3S/c1-3-4-13-23-17-9-7-16(8-10-17)14-19-20-24(21,22)18-11-5-15(2)6-12-18/h5-12,14,20H,3-4,13H2,1-2H3/b19-14+
InChIKey
JUJQCSZKMHUDES-XMHGGMMESA-N
Compound name
N-[(E)-(4-butoxyphenyl)methylideneamino]-4-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

346.1351 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.14238 181.7
[M+Na]+ 369.12432 193.2
[M+NH4]+ 364.16892 188.5
[M+K]+ 385.09826 183.9
[M-H]- 345.12782 186.0
[M+Na-2H]- 367.10977 189.5
[M]+ 346.13455 185.0
[M]- 346.13565 185.0
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

No patent data available for this compound.