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7,8-dimethyl-3-(3-nitrophenyl)-1,5-dihydro-2,4-benzodithiepin

View entire compound with spectra: 1 NMR

7,8-dimethyl-3-(3-nitrophenyl)-1,5-dihydro-2,4-benzodithiepin
SpectraBase Compound ID 2bDOEKP6tDO
InChI InChI=1S/C17H17NO2S2/c1-11-6-14-9-21-17(22-10-15(14)7-12(11)2)13-4-3-5-16(8-13)18(19)20/h3-8,17H,9-10H2,1-2H3
InChIKey SGYHASBDAVZOFG-UHFFFAOYSA-N
Mol Weight 331.45 g/mol
Molecular Formula C17H17NO2S2
Exact Mass 331.070071 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8DQFJiRsfG6
Name 7,8-dimethyl-3-(3-nitrophenyl)-1,5-dihydro-2,4-benzodithiepin
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/C17H17NO2S2/c1-11-6-14-9-21-17(22-10-15(14)7-12(11)2)13-4-3-5-16(8-13)18(19)20/h3-8,17H,9-10H2,1-2H3
InChIKey SGYHASBDAVZOFG-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_184
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 602093RRPA-028; Labnumber: 602093RRPA-028; VK_ID: VK-000185
Temperature 313 °C