CID 9588877

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

Structural Information

Molecular Formula
C15H13ClN2O4S
SMILES
COC(=O)C1=CC=CC=C1S(=O)(=O)N/N=C/C2=CC=C(C=C2)Cl
InChI
InChI=1S/C15H13ClN2O4S/c1-22-15(19)13-4-2-3-5-14(13)23(20,21)18-17-10-11-6-8-12(16)9-7-11/h2-10,18H,1H3/b17-10+
InChIKey
XFMJBYXPGGYSNZ-LICLKQGHSA-N
Compound name
methyl 2-[[(E)-(4-chlorophenyl)methylideneamino]sulfamoyl]benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

352.02844 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.03572 177.5
[M+Na]+ 375.01766 189.5
[M+NH4]+ 370.06226 183.9
[M+K]+ 390.99160 181.3
[M-H]- 351.02116 180.8
[M+Na-2H]- 373.00311 185.2
[M]+ 352.02789 180.7
[M]- 352.02899 180.7
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.