CID 5714958

2-(2-thienylmethylenehydrazino)benzothiazole

Structural Information

Molecular Formula
C12H9N3S2
SMILES
C1=CC=C2C(=C1)N=C(S2)N/N=C\C3=CC=CS3
InChI
InChI=1S/C12H9N3S2/c1-2-6-11-10(5-1)14-12(17-11)15-13-8-9-4-3-7-16-9/h1-8H,(H,14,15)/b13-8-
InChIKey
YHGVHRFSRANAMU-JYRVWZFOSA-N
Compound name
N-[(Z)-thiophen-2-ylmethylideneamino]-1,3-benzothiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.0238 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.03108 151.7
[M+Na]+ 282.01302 163.9
[M+NH4]+ 277.05762 162.1
[M+K]+ 297.98696 155.5
[M-H]- 258.01652 157.6
[M+Na-2H]- 279.99847 160.0
[M]+ 259.02325 156.0
[M]- 259.02435 156.0
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.