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N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-2-methylbenzamide
SpectraBase Compound ID HVucJSOBUTu
InChI InChI=1S/C18H18N2OS/c1-12-7-5-6-8-13(12)17(21)20-18-15(11-19)14-9-3-2-4-10-16(14)22-18/h5-8H,2-4,9-10H2,1H3,(H,20,21)
InChIKey VXEMAKYBRVZKSG-UHFFFAOYSA-N
Mol Weight 310.42 g/mol
Molecular Formula C18H18N2OS
Exact Mass 310.113984 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GAnoU4UpLnZ
Name N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-2-methylbenzamide
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/C18H18N2OS/c1-12-7-5-6-8-13(12)17(21)20-18-15(11-19)14-9-3-2-4-10-16(14)22-18/h5-8H,2-4,9-10H2,1H3,(H,20,21)
InChIKey VXEMAKYBRVZKSG-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_14380
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: UZI/9047419; Labnumber: NSB0063455; UZI_ID: UZI-014384
Temperature 318 °C