CID 3061271

Brn 4533246

Structural Information

Molecular Formula
C15H13N3O2S
SMILES
C1C(=NC2=CC=CC=C2S1)NNC(=O)C3=CC=CC=C3O
InChI
InChI=1S/C15H13N3O2S/c19-12-7-3-1-5-10(12)15(20)18-17-14-9-21-13-8-4-2-6-11(13)16-14/h1-8,19H,9H2,(H,16,17)(H,18,20)
InChIKey
DJZMICIYKAGIFZ-UHFFFAOYSA-N
Compound name
N'-(2H-1,4-benzothiazin-3-yl)-2-hydroxybenzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

299.07285 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 300.080126 162.6
[M+Na]+ 322.062068 169.1
[M-H]- 298.065574 167.3
[M+NH4]+ 317.106673 176.5
[M+K]+ 338.036008 163.6
[M+H-H2O]+ 282.070110 154.5
[M+HCOO]- 344.071051 178.9
[M+CH3COO]- 358.086701 172.9
[M+Na-2H]- 320.047516 168.7
[M]+ 299.07230142 161.2
[M]- 299.07339858 161.2
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.