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N-cyclohexyl-2-[(6-{3,5-dioxo-4-azatricyclo[5.2.1.0²,⁶]dec-8-en-4-yl}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
SpectraBase Compound ID HSqUrpPnwX6
InChI InChI=1S/C24H25N3O3S2/c28-19(25-15-4-2-1-3-5-15)12-31-24-26-17-9-8-16(11-18(17)32-24)27-22(29)20-13-6-7-14(10-13)21(20)23(27)30/h6-9,11,13-15,20-21H,1-5,10,12H2,(H,25,28)
InChIKey POXXCFJJBRXOSG-UHFFFAOYSA-N
Mol Weight 467.6 g/mol
Molecular Formula C24H25N3O3S2
Exact Mass 467.133734 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID zUu5vtknnZ
Name N-cyclohexyl-2-[(6-{3,5-dioxo-4-azatricyclo[5.2.1.0²,⁶]dec-8-en-4-yl}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 467.133734022 u
Formula C24H25N3O3S2
InChI InChI=1S/C24H25N3O3S2/c28-19(25-15-4-2-1-3-5-15)12-31-24-26-17-9-8-16(11-18(17)32-24)27-22(29)20-13-6-7-14(10-13)21(20)23(27)30/h6-9,11,13-15,20-21H,1-5,10,12H2,(H,25,28)
InChIKey POXXCFJJBRXOSG-UHFFFAOYSA-N
Molecular Weight 467.602 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9975
Solvent DMSO-d6
Source Vendor ID: NMR/9253654; Lab Info: LP; Lab Number: LP-0609150