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N-[(5-hydroxy-4-oxo-4H-pyran-2-yl)methyl]-N,N-dimethyl-1-decanaminium bromide
SpectraBase Compound ID 9RP0WAhZk9y
InChI InChI=1S/C18H31NO3.BrH/c1-4-5-6-7-8-9-10-11-12-19(2,3)14-16-13-17(20)18(21)15-22-16;/h13,15H,4-12,14H2,1-3H3;1H
InChIKey TXMCZOKOGFSVPN-UHFFFAOYSA-N
Mol Weight 390.4 g/mol
Molecular Formula C18H32BrNO3
Exact Mass 389.156557 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5Jsy1GlRiFf
Name N-[(5-hydroxy-4-oxo-4H-pyran-2-yl)methyl]-N,N-dimethyl-1-decanaminium bromide
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/C18H31NO3.BrH/c1-4-5-6-7-8-9-10-11-12-19(2,3)14-16-13-17(20)18(21)15-22-16;/h13,15H,4-12,14H2,1-3H3;1H
InChIKey TXMCZOKOGFSVPN-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_15054
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: 987/00001266; Labnumber: 987/00001266218814; VK_ID: VK-015059
Temperature 318 °C