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

*Links on SpectraBase are not permalinks.
4-ethyl-3-(4-methoxyphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazole
SpectraBase Compound ID AVuQtpAj013
InChI InChI=1S/C18H18N4O3S/c1-3-21-17(14-6-10-16(25-2)11-7-14)19-20-18(21)26-12-13-4-8-15(9-5-13)22(23)24/h4-11H,3,12H2,1-2H3
InChIKey AQCRCBXNZLRMQR-UHFFFAOYSA-N
Mol Weight 370.43 g/mol
Molecular Formula C18H18N4O3S
Exact Mass 370.109962 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 4LnaD38cBAU
Name 4-ethyl-3-(4-methoxyphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazole
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/C18H18N4O3S/c1-3-21-17(14-6-10-16(25-2)11-7-14)19-20-18(21)26-12-13-4-8-15(9-5-13)22(23)24/h4-11H,3,12H2,1-2H3
InChIKey AQCRCBXNZLRMQR-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4392
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: D98934; Labnumber: GRES-28745; SBI_ID: SBI-004394
Synonyms 4-{4-ethyl-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}phenyl methyl ether
Temperature 306 °C