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3-[(2E)-3-chloro-2-butenyl]-2-sulfanyl-4(3H)-quinazolinone

View entire compound with spectra: 1 NMR

3-[(2E)-3-chloro-2-butenyl]-2-sulfanyl-4(3H)-quinazolinone
SpectraBase Compound ID 3lqyPnmoANy
InChI InChI=1S/C12H11ClN2OS/c1-8(13)6-7-15-11(16)9-4-2-3-5-10(9)14-12(15)17/h2-6H,7H2,1H3,(H,14,17)/b8-6+
InChIKey XYTVGKIHMWOZPA-SOFGYWHQSA-N
Mol Weight 266.75 g/mol
Molecular Formula C12H11ClN2OS
Exact Mass 266.028062 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DBgmZYQ7cCp
Name 3-[(2E)-3-chloro-2-butenyl]-2-sulfanyl-4(3H)-quinazolinone
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/C12H11ClN2OS/c1-8(13)6-7-15-11(16)9-4-2-3-5-10(9)14-12(15)17/h2-6H,7H2,1H3,(H,14,17)/b8-6+
InChIKey XYTVGKIHMWOZPA-SOFGYWHQSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21284
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: D52199; Labnumber: AENIC71-0347; SBI_ID: SBI-021288
Synonyms 3-[3-chloro-2-butenyl]-2-sulfanyl-4(3H)-quinazolinone
Temperature 318 °C