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N-{[2-(ethoxycarbonyl)-4-hydroxy-1-benzofuran-3-yl]methyl}-1-butanaminium chloride
SpectraBase Compound ID BO7vMXRY3Ew
InChI InChI=1S/C16H21NO4.ClH/c1-3-5-9-17-10-11-14-12(18)7-6-8-13(14)21-15(11)16(19)20-4-2;/h6-8,17-18H,3-5,9-10H2,1-2H3;1H
InChIKey FEPKZOKPJFTLJH-UHFFFAOYSA-N
Mol Weight 327.81 g/mol
Molecular Formula C16H22ClNO4
Exact Mass 327.123736 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KMVLm4vPyFB
Name N-{[2-(ethoxycarbonyl)-4-hydroxy-1-benzofuran-3-yl]methyl}-1-butanaminium chloride
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/C16H21NO4.ClH/c1-3-5-9-17-10-11-14-12(18)7-6-8-13(14)21-15(11)16(19)20-4-2;/h6-8,17-18H,3-5,9-10H2,1-2H3;1H
InChIKey FEPKZOKPJFTLJH-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_24046
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: D44211; Labnumber: GRAN211-089; SBI_ID: SBI-024050
Temperature 308 °C