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N-[2-bromo-5-ethoxy-4-(2-propynyloxy)benzyl]cyclopentanaminium chloride
SpectraBase Compound ID FFfFVLLngtY
InChI InChI=1S/C17H22BrNO2.ClH/c1-3-9-21-17-11-15(18)13(10-16(17)20-4-2)12-19-14-7-5-6-8-14;/h1,10-11,14,19H,4-9,12H2,2H3;1H
InChIKey AICHPSVURDQCSK-UHFFFAOYSA-N
Mol Weight 388.73 g/mol
Molecular Formula C17H23BrClNO2
Exact Mass 387.06007 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IJUlnTdPaeR
Name N-[2-bromo-5-ethoxy-4-(2-propynyloxy)benzyl]cyclopentanaminium 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/C17H22BrNO2.ClH/c1-3-9-21-17-11-15(18)13(10-16(17)20-4-2)12-19-14-7-5-6-8-14;/h1,10-11,14,19H,4-9,12H2,2H3;1H
InChIKey AICHPSVURDQCSK-UHFFFAOYSA-N
NMR Offset 17.9109
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_31529
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: 1842976; SBI_ID: SBI-031533
Temperature 303 °C