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N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-N'-(3,4-difluorobenzoyl)thiourea

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N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-N'-(3,4-difluorobenzoyl)thiourea
SpectraBase Compound ID GFwqtUV1oYo
InChI InChI=1S/C18H15F2N3OS2/c19-13-7-6-10(8-14(13)20)16(24)22-18(25)23-17-12(9-21)11-4-2-1-3-5-15(11)26-17/h6-8H,1-5H2,(H2,22,23,24,25)
InChIKey MKKSLAWAHVJHHL-UHFFFAOYSA-N
Mol Weight 391.45 g/mol
Molecular Formula C18H15F2N3OS2
Exact Mass 391.062461 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1Cg8JhRu3vs
Name N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-N'-(3,4-difluorobenzoyl)thiourea
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/C18H15F2N3OS2/c19-13-7-6-10(8-14(13)20)16(24)22-18(25)23-17-12(9-21)11-4-2-1-3-5-15(11)26-17/h6-8H,1-5H2,(H2,22,23,24,25)
InChIKey MKKSLAWAHVJHHL-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34515
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: 9031820; SBI_ID: SBI-034519
Temperature 318 °C