CID 3061274

Brn 4502109

Structural Information

Molecular Formula
C14H12N4OS
SMILES
C1C(=NC2=CC=CC=C2S1)NNC(=O)C3=CC=NC=C3
InChI
InChI=1S/C14H12N4OS/c19-14(10-5-7-15-8-6-10)18-17-13-9-20-12-4-2-1-3-11(12)16-13/h1-8H,9H2,(H,16,17)(H,18,19)
InChIKey
DLTKKKXRJGEQLW-UHFFFAOYSA-N
Compound name
N'-(2H-1,4-benzothiazin-3-yl)pyridine-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.07318 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.08046 159.4
[M+Na]+ 307.06240 172.6
[M+NH4]+ 302.10700 168.0
[M+K]+ 323.03634 163.3
[M-H]- 283.06590 164.6
[M+Na-2H]- 305.04785 168.7
[M]+ 284.07263 163.1
[M]- 284.07373 163.1
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.