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N-[5-amino-1-(chloroacetyl)pentyl]-p-toluenesulfonamide, monohydrochloride
SpectraBase Compound ID Fhjd1zk2J3g
InChI InChI=1S/C14H21ClN2O3S.ClH/c1-11-5-7-12(8-6-11)21(19,20)17-13(14(18)10-15)4-2-3-9-16;/h5-8,13,17H,2-4,9-10,16H2,1H3;1H
InChIKey YFCUZWYIPBUQBD-UHFFFAOYSA-N
Mol Weight 369.31 g/mol
Molecular Formula C14H22Cl2N2O3S
Exact Mass 368.072819 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LIzDnCQGW90
Name (5S)-7-chloro-5-{[(4-methylphenyl)sulfonyl]amino}-6-oxo-1-heptanaminium 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/C14H21ClN2O3S.ClH/c1-11-5-7-12(8-6-11)21(19,20)17-13(14(18)10-15)4-2-3-9-16;/h5-8,13,17H,2-4,9-10,16H2,1H3;1H
InChIKey YFCUZWYIPBUQBD-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16039
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: 987/00003086; Labnumber: 987/00003086218837; VK_ID: VK-016044
Synonyms 7-chloro-5-{[(4-methylphenyl)sulfonyl]amino}-6-oxo-1-heptanaminium chloride
Temperature 318 °C