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2-{[6-chloro-3-(2-hydroxypropyl)-4-methyl-2-oxo-2H-chromen-7-yl]oxy}-N-(4-methoxyphenyl)acetamide
SpectraBase Compound ID KOpDcghsqRB
InChI InChI=1S/C22H22ClNO6/c1-12(25)8-17-13(2)16-9-18(23)20(10-19(16)30-22(17)27)29-11-21(26)24-14-4-6-15(28-3)7-5-14/h4-7,9-10,12,25H,8,11H2,1-3H3,(H,24,26)
InChIKey UULGQYGSLFXUDO-UHFFFAOYSA-N
Mol Weight 431.87 g/mol
Molecular Formula C22H22ClNO6
Exact Mass 431.113565 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GHdNkbTFBaz
Name 2-{[6-chloro-3-(2-hydroxypropyl)-4-methyl-2-oxo-2H-chromen-7-yl]oxy}-N-(4-methoxyphenyl)acetamide
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/C22H22ClNO6/c1-12(25)8-17-13(2)16-9-18(23)20(10-19(16)30-22(17)27)29-11-21(26)24-14-4-6-15(28-3)7-5-14/h4-7,9-10,12,25H,8,11H2,1-3H3,(H,24,26)
InChIKey UULGQYGSLFXUDO-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_594
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: C34268; Labnumber: MTOL-0696; SBI_ID: SBI-000596
Temperature 318 °C