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

*Links on SpectraBase are not permalinks.
(6E)-6-{4-[(2-fluorobenzyl)oxy]-3-methoxybenzylidene}-5-imino-2-[2-oxo-2-(1-piperidinyl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID 5lINM1NEAL2
InChI InChI=1S/C27H26FN5O4S/c1-36-22-14-17(9-10-21(22)37-16-18-7-3-4-8-20(18)28)13-19-25(29)33-27(30-26(19)35)38-23(31-33)15-24(34)32-11-5-2-6-12-32/h3-4,7-10,13-14,29H,2,5-6,11-12,15-16H2,1H3/b19-13+,29-25?
InChIKey UHURQSWYEXMMOO-SSYJJTASSA-N
Mol Weight 535.59 g/mol
Molecular Formula C27H26FN5O4S
Exact Mass 535.168954 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 8HpfkwQMTo1
Name (6E)-6-{4-[(2-fluorobenzyl)oxy]-3-methoxybenzylidene}-5-imino-2-[2-oxo-2-(1-piperidinyl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
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/C27H26FN5O4S/c1-36-22-14-17(9-10-21(22)37-16-18-7-3-4-8-20(18)28)13-19-25(29)33-27(30-26(19)35)38-23(31-33)15-24(34)32-11-5-2-6-12-32/h3-4,7-10,13-14,29H,2,5-6,11-12,15-16H2,1H3/b19-13+,29-25?
InChIKey UHURQSWYEXMMOO-SSYJJTASSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25886
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: D61713; Labnumber: CEP5-0923; SBI_ID: SBI-025890
Synonyms 6-{4-[(2-fluorobenzyl)oxy]-3-methoxybenzylidene}-5-imino-2-[2-oxo-2-(1-piperidinyl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Temperature 318 °C