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acetamide, N-[2-(1-cyclohexen-1-yl)ethyl]-2-[[6,7,8,9-tetrahydro-4-(trifluoromethyl)-5H-cyclohepta[d]pyrimidin-2-yl]thio]-

View entire compound with spectra: 1 NMR

acetamide, N-[2-(1-cyclohexen-1-yl)ethyl]-2-[[6,7,8,9-tetrahydro-4-(trifluoromethyl)-5H-cyclohepta[d]pyrimidin-2-yl]thio]-
SpectraBase Compound ID JL6KYPqEt0N
InChI InChI=1S/C20H26F3N3OS/c21-20(22,23)18-15-9-5-2-6-10-16(15)25-19(26-18)28-13-17(27)24-12-11-14-7-3-1-4-8-14/h7H,1-6,8-13H2,(H,24,27)
InChIKey QJNDWAGIQQZMQI-UHFFFAOYSA-N
Mol Weight 413.5 g/mol
Molecular Formula C20H26F3N3OS
Exact Mass 413.174868 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F7NGEUn6asX
Name acetamide, N-[2-(1-cyclohexen-1-yl)ethyl]-2-[[6,7,8,9-tetrahydro-4-(trifluoromethyl)-5H-cyclohepta[d]pyrimidin-2-yl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 413.174868131 u
Formula C20H26F3N3OS
InChI InChI=1S/C20H26F3N3OS/c21-20(22,23)18-15-9-5-2-6-10-16(15)25-19(26-18)28-13-17(27)24-12-11-14-7-3-1-4-8-14/h7H,1-6,8-13H2,(H,24,27)
InChIKey QJNDWAGIQQZMQI-UHFFFAOYSA-N
Molecular Weight 413.503 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_1233
Solvent DMSO-d6
Source Vendor ID: NMR/13239904