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acetamide, N-[4-[(5E)-2-imino-4-oxo-5-[[5-[3-(trifluoromethyl)phenyl]-2-furanyl]methylene]thiazolidinyl]-1,2,5-oxadiazol-3-yl]-
SpectraBase Compound ID I4lFZo2dFsa
InChI InChI=1S/C19H12F3N5O4S/c1-9(28)24-15-16(26-31-25-15)27-17(29)14(32-18(27)23)8-12-5-6-13(30-12)10-3-2-4-11(7-10)19(20,21)22/h2-8,23H,1H3,(H,24,25,28)/b14-8+,23-18?
InChIKey XUPWKOUSMQKZME-LANNQIRMSA-N
Mol Weight 463.39 g/mol
Molecular Formula C19H12F3N5O4S
Exact Mass 463.05621 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 96PgoX4DFWN
Name acetamide, N-[4-[(5E)-2-imino-4-oxo-5-[[5-[3-(trifluoromethyl)phenyl]-2-furanyl]methylene]thiazolidinyl]-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 463.056209545 u
Formula C19H12F3N5O4S
InChI InChI=1S/C19H12F3N5O4S/c1-9(28)24-15-16(26-31-25-15)27-17(29)14(32-18(27)23)8-12-5-6-13(30-12)10-3-2-4-11(7-10)19(20,21)22/h2-8,23H,1H3,(H,24,25,28)/b14-8+,23-18?
InChIKey XUPWKOUSMQKZME-LANNQIRMSA-N
Molecular Weight 463.391 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14627
Solvent DMSO-d6
Source Vendor ID: NMR/10310727; Lab Info: SAD; Lab Number: 69