CID 135480749

(2e)-2-(1,3-benzothiazol-2-ylhydrazono)indolin-3-one

Structural Information

Molecular Formula
C15H10N4OS
SMILES
C1=CC=C2C(=C1)C(=C(N2)/N=N/C3=NC4=CC=CC=C4S3)O
InChI
InChI=1S/C15H10N4OS/c20-13-9-5-1-2-6-10(9)16-14(13)18-19-15-17-11-7-3-4-8-12(11)21-15/h1-8,16,20H/b19-18+
InChIKey
PDNMMXTXKHHCGQ-VHEBQXMUSA-N
Compound name
2-[(E)-1,3-benzothiazol-2-yldiazenyl]-1H-indol-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

294.05753 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.06481 160.5
[M+Na]+ 317.04675 173.7
[M-H]- 293.05025 169.0
[M+NH4]+ 312.09135 179.7
[M+K]+ 333.02069 167.6
[M+H-H2O]+ 277.05479 153.8
[M+HCOO]- 339.05573 184.0
[M+CH3COO]- 353.07138 174.4
[M+Na-2H]- 315.03220 167.4
[M]+ 294.05698 166.8
[M]- 294.05808 166.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.