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

*Links on SpectraBase are not permalinks.

1H-1,2,4-Triazole-1-acetonitrile, .alpha.-[2-ethyl-1-[[(4-methylphenyl)sulfonyl]oxy]butylidene]-

View entire compound with spectra: 1 NMR

1H-1,2,4-Triazole-1-acetonitrile, .alpha.-[2-ethyl-1-[[(4-methylphenyl)sulfonyl]oxy]butylidene]-
SpectraBase Compound ID 4TXveovfywx
InChI InChI=1S/C17H20N4O3S/c1-4-14(5-2)17(16(10-18)21-12-19-11-20-21)24-25(22,23)15-8-6-13(3)7-9-15/h6-9,11-12,14H,4-5H2,1-3H3/b17-16-
InChIKey POVVJRIQDYMXNX-MSUUIHNZSA-N
Mol Weight 360.43 g/mol
Molecular Formula C17H20N4O3S
Exact Mass 360.125612 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 3kNtHm7vM44
Name 1H-1,2,4-Triazole-1-acetonitrile, .alpha.-[2-ethyl-1-[[(4-methylphenyl)sulfonyl]oxy]butylidene]-
CAS Registry Number 120070-13-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H20N4O3S
InChI InChI=1S/C17H20N4O3S/c1-4-14(5-2)17(16(10-18)21-12-19-11-20-21)24-25(22,23)15-8-6-13(3)7-9-15/h6-9,11-12,14H,4-5H2,1-3H3/b17-16-
InChIKey POVVJRIQDYMXNX-MSUUIHNZSA-N
Instrument Name Bruker AM-270
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3