For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1-(1,3-benzothiazol-2-yl)-6-(3-methylphenyl)-1,5,6,7-tetrahydro-4H-indazol-4-one

View entire compound with spectra: 2 NMR

1-(1,3-benzothiazol-2-yl)-6-(3-methylphenyl)-1,5,6,7-tetrahydro-4H-indazol-4-one
SpectraBase Compound ID 41KhRYyurYL
InChI InChI=1S/C21H17N3OS/c1-13-5-4-6-14(9-13)15-10-18-16(19(25)11-15)12-22-24(18)21-23-17-7-2-3-8-20(17)26-21/h2-9,12,15H,10-11H2,1H3
InChIKey GNEJNLQPFRJYHP-UHFFFAOYSA-N
Mol Weight 359.45 g/mol
Molecular Formula C21H17N3OS
Exact Mass 359.109233 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9VdZzLIJbFR
Name 1-(1,3-Benzothiazol-2-yl)-6-(3-methylphenyl)-1,5,6,7-tetrahydro-4H-indazol-4-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 359.109233352 u
Formula C21H17N3OS
InChI InChI=1S/C21H17N3OS/c1-13-5-4-6-14(9-13)15-10-18-16(19(25)11-15)12-22-24(18)21-23-17-7-2-3-8-20(17)26-21/h2-9,12,15H,10-11H2,1H3
InChIKey GNEJNLQPFRJYHP-UHFFFAOYSA-N
Molecular Weight 359.447 g/mol
SMILES C1(N2C3=C(C(=O)CC(C3)C=3C=C(C)C=CC3)C=N2)=NC=2C=CC=CC2S1