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2-(7,8-Dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)-6-nitrophenol
SpectraBase Compound ID 6q8YM4i1ED6
InChI InChI=1S/C17H17NO3S2/c1-10-6-12-8-22-17(23-9-13(12)7-11(10)2)14-4-3-5-15(16(14)19)18(20)21/h3-7,17,19H,8-9H2,1-2H3
InChIKey IYKNAMAXZLQEBE-UHFFFAOYSA-N
Mol Weight 347.45 g/mol
Molecular Formula C17H17NO3S2
Exact Mass 347.064986 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FhjrwZOM5Y1
Name phenol, 2-(1,5-dihydro-7,8-dimethyl-2,4-benzodithiepin-3-yl)-6-nitro-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 347.064985756 u
Formula C17H17NO3S2
InChI InChI=1S/C17H17NO3S2/c1-10-6-12-8-22-17(23-9-13(12)7-11(10)2)14-4-3-5-15(16(14)19)18(20)21/h3-7,17,19H,8-9H2,1-2H3
InChIKey IYKNAMAXZLQEBE-UHFFFAOYSA-N
Molecular Weight 347.447 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_2366
Solvent DMSO-d6
Source Vendor ID: ZI/9015956; Lab Info: RVP; Lab Number: RVP-rrv2537