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2-chloro-1-(chloromethyl)ethyl 5-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoate
SpectraBase Compound ID 3KzJAADE6vQ
InChI InChI=1S/C16H18Cl2N2O4S/c1-23-10-5-6-12-13(7-10)25-16(19-12)20-14(21)3-2-4-15(22)24-11(8-17)9-18/h5-7,11H,2-4,8-9H2,1H3,(H,19,20,21)
InChIKey OJWACBRKGCFSTJ-UHFFFAOYSA-N
Mol Weight 405.3 g/mol
Molecular Formula C16H18Cl2N2O4S
Exact Mass 404.036434 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GbaNjC2wzs8
Name 2-chloro-1-(chloromethyl)ethyl 5-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-5-oxopentanoate
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/C16H18Cl2N2O4S/c1-23-10-5-6-12-13(7-10)25-16(19-12)20-14(21)3-2-4-15(22)24-11(8-17)9-18/h5-7,11H,2-4,8-9H2,1H3,(H,19,20,21)
InChIKey OJWACBRKGCFSTJ-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_20428
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: UZI/9164858; UBI_ID: UBI-020432
Temperature 313 °C