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

*Links on SpectraBase are not permalinks.
4-{(E)-[({[3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}acetyl)hydrazono]methyl}-2,6-dimethoxyphenyl acetate
SpectraBase Compound ID FN9sbpCAjLE
InChI InChI=1S/C27H23ClN4O6S/c1-16(33)38-25-22(36-2)12-17(13-23(25)37-3)14-29-31-24(34)15-39-27-30-21-7-5-4-6-20(21)26(35)32(27)19-10-8-18(28)9-11-19/h4-14H,15H2,1-3H3,(H,31,34)/b29-14+
InChIKey XEOCBIYYSOTFQP-IPPBACCNSA-N
Mol Weight 567.02 g/mol
Molecular Formula C27H23ClN4O6S
Exact Mass 566.102683 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 2gtfHNJojWv
Name 4-{(E)-[({[3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}acetyl)hydrazono]methyl}-2,6-dimethoxyphenyl acetate
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/C27H23ClN4O6S/c1-16(33)38-25-22(36-2)12-17(13-23(25)37-3)14-29-31-24(34)15-39-27-30-21-7-5-4-6-20(21)26(35)32(27)19-10-8-18(28)9-11-19/h4-14H,15H2,1-3H3,(H,31,34)/b29-14+
InChIKey XEOCBIYYSOTFQP-IPPBACCNSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16988
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: D24706; Labnumber: GRES-02704; SBI_ID: SBI-016991
Synonyms 4-{[({[3-(4-chlorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}acetyl)hydrazono]methyl}-2,6-dimethoxyphenyl acetate
Temperature 308 °C