CID 13277846

Brn 5617216

Structural Information

Molecular Formula
C14H13N3O5S
SMILES
C1=CC=C(C=C1)S(=O)(=O)NNC(=O)C(=O)NC2=CC=C(C=C2)O
InChI
InChI=1S/C14H13N3O5S/c18-11-8-6-10(7-9-11)15-13(19)14(20)16-17-23(21,22)12-4-2-1-3-5-12/h1-9,17-18H,(H,15,19)(H,16,20)
InChIKey
MRAGBMUBQJGQDL-UHFFFAOYSA-N
Compound name
2-[2-(benzenesulfonyl)hydrazinyl]-N-(4-hydroxyphenyl)-2-oxoacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

335.0576 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.064876 171.4
[M+Na]+ 358.046818 175.9
[M-H]- 334.050324 176.5
[M+NH4]+ 353.091423 182.9
[M+K]+ 374.020758 172.3
[M+H-H2O]+ 318.054860 163.2
[M+HCOO]- 380.055801 190.1
[M+CH3COO]- 394.071451 207.7
[M+Na-2H]- 356.032266 176.6
[M]+ 335.05705142 171.2
[M]- 335.05814858 171.2
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.