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7-[(4-nitrophenyl)sulfonyl]-2,2-bis(trifluoromethyl)-2,3-dihydro-4H-[1,3]thiazolo[3,2-a][1,3,5]triazin-4-one
SpectraBase Compound ID 6FZZxFSc7Pt
InChI InChI=1S/C13H6F6N4O5S2/c14-12(15,16)11(13(17,18)19)20-9(24)22-5-8(29-10(22)21-11)30(27,28)7-3-1-6(2-4-7)23(25)26/h1-5H,(H,20,24)
InChIKey MIKWHOHZKMHGTB-UHFFFAOYSA-N
Mol Weight 476.32 g/mol
Molecular Formula C13H6F6N4O5S2
Exact Mass 475.968381 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7fhZ8CHPRcY
Name 7-[(4-nitrophenyl)sulfonyl]-2,2-bis(trifluoromethyl)-2,3-dihydro-4H-[1,3]thiazolo[3,2-a][1,3,5]triazin-4-one
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/C13H6F6N4O5S2/c14-12(15,16)11(13(17,18)19)20-9(24)22-5-8(29-10(22)21-11)30(27,28)7-3-1-6(2-4-7)23(25)26/h1-5H,(H,20,24)
InChIKey MIKWHOHZKMHGTB-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_468
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: C27182; Labnumber: SOK-1112; SBI_ID: SBI-000470
Temperature 308 °C