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1-butanaminium, N-[3-[[2-(ethoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-3-yl]amino]-3-oxopropyl]-, chloride
SpectraBase Compound ID 1RC5XgTNC3v
InChI InChI=1S/C18H28N2O3S.ClH/c1-3-5-11-19-12-10-15(21)20-16-13-8-6-7-9-14(13)24-17(16)18(22)23-4-2;/h19H,3-12H2,1-2H3,(H,20,21);1H
InChIKey XQASGZOHWXHNDW-UHFFFAOYSA-N
Mol Weight 388.95 g/mol
Molecular Formula C18H29ClN2O3S
Exact Mass 388.158742 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7pEEpYfK9Xn
Name 1-butanaminium, N-[3-[[2-(ethoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thien-3-yl]amino]-3-oxopropyl]-, 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/C18H28N2O3S.ClH/c1-3-5-11-19-12-10-15(21)20-16-13-8-6-7-9-14(13)24-17(16)18(22)23-4-2;/h19H,3-12H2,1-2H3,(H,20,21);1H
InChIKey XQASGZOHWXHNDW-UHFFFAOYSA-N
NMR Offset 15.2038
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_8516_6264
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: ZI/6014486; Labnumber: SMM-1067; IOH_ID: IOH-013267
Temperature 297 °C