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5,5-dimethyl-3-[4-(5-methyl-1,3-benzothiazol-2-yl)anilino]-2-cyclohexen-1-one
SpectraBase Compound ID K06tzjgwlpy
InChI InChI=1S/C22H22N2OS/c1-14-4-9-20-19(10-14)24-21(26-20)15-5-7-16(8-6-15)23-17-11-18(25)13-22(2,3)12-17/h4-11,23H,12-13H2,1-3H3
InChIKey NYBPKOGJQIZTJM-UHFFFAOYSA-N
Mol Weight 362.49 g/mol
Molecular Formula C22H22N2OS
Exact Mass 362.145285 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D9ZAQdkVXCs
Name 5,5-dimethyl-3-[4-(5-methyl-1,3-benzothiazol-2-yl)anilino]-2-cyclohexen-1-one
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C22H22N2OS/c1-14-4-9-20-19(10-14)24-21(26-20)15-5-7-16(8-6-15)23-17-11-18(25)13-22(2,3)12-17/h4-11,23H,12-13H2,1-3H3
InChIKey NYBPKOGJQIZTJM-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_18126
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: UZI/9119878; UBI_ID: UBI-018129
Temperature 308 °C