CID 9588875

Methyl 2-((((4-methoxyphenyl)methylene)hydrazino)sulfonyl)benzoate

Structural Information

Molecular Formula
C16H16N2O5S
SMILES
COC1=CC=C(C=C1)/C=N/NS(=O)(=O)C2=CC=CC=C2C(=O)OC
InChI
InChI=1S/C16H16N2O5S/c1-22-13-9-7-12(8-10-13)11-17-18-24(20,21)15-6-4-3-5-14(15)16(19)23-2/h3-11,18H,1-2H3/b17-11+
InChIKey
GAYAOMBTHRGTKK-GZTJUZNOSA-N
Compound name
methyl 2-[[(E)-(4-methoxyphenyl)methylideneamino]sulfamoyl]benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

348.078 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.08528 177.9
[M+Na]+ 371.06722 188.4
[M+NH4]+ 366.11182 183.4
[M+K]+ 387.04116 181.5
[M-H]- 347.07072 180.7
[M+Na-2H]- 369.05267 185.0
[M]+ 348.07745 180.4
[M]- 348.07855 180.4
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.