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3-[(2H-1,3-benzodioxol-5-yl)(4-methyl-2-oxo-2H-thiochromen-3-yl)methyl]-4-methyl-2H-thiochromen-2-one
SpectraBase Compound ID 8R2p230lIdb
InChI InChI=1S/C26H16O6S2/c27-23-14-5-1-3-7-18(14)33-25(29)21(23)20(13-9-10-16-17(11-13)32-12-31-16)22-24(28)15-6-2-4-8-19(15)34-26(22)30/h1-11,20,27-28H,12H2
InChIKey ZEQCFZCNFPWKGI-UHFFFAOYSA-N
Mol Weight 488.53 g/mol
Molecular Formula C26H16O6S2
Exact Mass 488.038831 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2IDNKOnko7
Name 3-[(2H-1,3-benzodioxol-5-yl)(4-methyl-2-oxo-2H-thiochromen-3-yl)methyl]-4-methyl-2H-thiochromen-2-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 488.038830577 u
Formula C26H16O6S2
InChI InChI=1S/C26H16O6S2/c27-23-14-5-1-3-7-18(14)33-25(29)21(23)20(13-9-10-16-17(11-13)32-12-31-16)22-24(28)15-6-2-4-8-19(15)34-26(22)30/h1-11,20,27-28H,12H2
InChIKey ZEQCFZCNFPWKGI-UHFFFAOYSA-N
Molecular Weight 488.528 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7639
Solvent DMSO-d6
Source Vendor ID: NMR/13308423