For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
acetamide, 2-[[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]thio]-N-[4-(trifluoromethoxy)phenyl]-
SpectraBase Compound ID 1C6WkKysOjv
InChI InChI=1S/C26H20F3N5O2S/c27-26(28,29)36-19-12-10-18(11-13-19)30-22(35)16-37-25-31-24-23(32-33-25)20-8-4-5-9-21(20)34(24)15-14-17-6-2-1-3-7-17/h1-13H,14-16H2,(H,30,35)
InChIKey NRXDOUYJJSBLJI-UHFFFAOYSA-N
Mol Weight 523.53 g/mol
Molecular Formula C26H20F3N5O2S
Exact Mass 523.128981 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HuNesjyl3h0
Name acetamide, 2-[[5-(2-phenylethyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]thio]-N-[4-(trifluoromethoxy)phenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 523.128980565 u
Formula C26H20F3N5O2S
InChI InChI=1S/C26H20F3N5O2S/c27-26(28,29)36-19-12-10-18(11-13-19)30-22(35)16-37-25-31-24-23(32-33-25)20-8-4-5-9-21(20)34(24)15-14-17-6-2-1-3-7-17/h1-13H,14-16H2,(H,30,35)
InChIKey NRXDOUYJJSBLJI-UHFFFAOYSA-N
Molecular Weight 523.534 g/mol
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4604
Solvent DMSO-d6
Source Vendor ID: NMR/9302726; Lab Info: l-23; Lab Number: l-23/0001604