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2-phenyl-N-(2,2,2-trichloro-1-{[(cycloheptylideneamino)carbothioyl]amino}ethyl)acetamide
SpectraBase Compound ID AfxZminNA2p
InChI InChI=1S/C18H22Cl3N3OS/c19-18(20,21)16(23-15(25)12-13-8-4-3-5-9-13)24-17(26)22-14-10-6-1-2-7-11-14/h3-5,8-9,16H,1-2,6-7,10-12H2,(H,23,25)(H,24,26)
InChIKey RQQDDCREIAXJES-UHFFFAOYSA-N
Mol Weight 434.81 g/mol
Molecular Formula C18H22Cl3N3OS
Exact Mass 433.054917 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 60qXsnPMLb7
Name 2-phenyl-N-(2,2,2-trichloro-1-{[(cycloheptylideneamino)carbothioyl]amino}ethyl)acetamide
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/C18H22Cl3N3OS/c19-18(20,21)16(23-15(25)12-13-8-4-3-5-9-13)24-17(26)22-14-10-6-1-2-7-11-14/h3-5,8-9,16H,1-2,6-7,10-12H2,(H,23,25)(H,24,26)
InChIKey RQQDDCREIAXJES-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16728
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: 987/00004297; Labnumber: 987/00004297218852; VK_ID: VK-016733
Temperature 318 °C