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acetamide, N-[4-[(5E)-5-[[4-(acetyloxy)-2-chloro-5-methoxyphenyl]methylene]-2-imino-4-oxothiazolidinyl]-1,2,5-oxadiazol-3-yl]-
SpectraBase Compound ID 5IrJjCqvviW
InChI InChI=1S/C17H14ClN5O6S/c1-7(24)20-14-15(22-29-21-14)23-16(26)13(30-17(23)19)5-9-4-11(27-3)12(6-10(9)18)28-8(2)25/h4-6,19H,1-3H3,(H,20,21,24)/b13-5+,19-17?
InChIKey PSYFQZDSOHMIHD-SRNIEEMRSA-N
Mol Weight 451.84 g/mol
Molecular Formula C17H14ClN5O6S
Exact Mass 451.035332 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Km0ac4mR4o2
Name acetamide, N-[4-[(5E)-5-[[4-(acetyloxy)-2-chloro-5-methoxyphenyl]methylene]-2-imino-4-oxothiazolidinyl]-1,2,5-oxadiazol-3-yl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 451.035332059 u
Formula C17H14ClN5O6S
InChI InChI=1S/C17H14ClN5O6S/c1-7(24)20-14-15(22-29-21-14)23-16(26)13(30-17(23)19)5-9-4-11(27-3)12(6-10(9)18)28-8(2)25/h4-6,19H,1-3H3,(H,20,21,24)/b13-5+,19-17?
InChIKey PSYFQZDSOHMIHD-SRNIEEMRSA-N
Molecular Weight 451.841 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14629
Solvent DMSO-d6
Source Vendor ID: NMR/10310752; Lab Info: SAD; Lab Number: 92