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2H,8H-pyrano[2,3-f][1,3]benzoxazine-3-propanoic acid, 9,10-dihydro-4-methyl-2-oxo-9-(tetrahydro-3-methyl-1,1-dioxido-3-thienyl)-, ethyl ester

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2H,8H-pyrano[2,3-f][1,3]benzoxazine-3-propanoic acid, 9,10-dihydro-4-methyl-2-oxo-9-(tetrahydro-3-methyl-1,1-dioxido-3-thienyl)-, ethyl ester
SpectraBase Compound ID 5KJ8eG6ZLsw
InChI InChI=1S/C22H27NO7S/c1-4-28-19(24)8-6-16-14(2)15-5-7-18-17(20(15)30-21(16)25)11-23(13-29-18)22(3)9-10-31(26,27)12-22/h5,7H,4,6,8-13H2,1-3H3
InChIKey YBDDZQUVZSOMLR-UHFFFAOYSA-N
Mol Weight 449.52 g/mol
Molecular Formula C22H27NO7S
Exact Mass 449.150823 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AjIhAQcObE4
Name 2H,8H-pyrano[2,3-f][1,3]benzoxazine-3-propanoic acid, 9,10-dihydro-4-methyl-2-oxo-9-(tetrahydro-3-methyl-1,1-dioxido-3-thienyl)-, ethyl ester
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/C22H27NO7S/c1-4-28-19(24)8-6-16-14(2)15-5-7-18-17(20(15)30-21(16)25)11-23(13-29-18)22(3)9-10-31(26,27)12-22/h5,7H,4,6,8-13H2,1-3H3
InChIKey YBDDZQUVZSOMLR-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_1139
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: F07469; Labnumber: ExLab-125291