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4-phenyl-1-[N-(alpha,alpha,alpha-trifluoro-p-toluoyl)methoxy]semicarbazide

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4-phenyl-1-[N-(alpha,alpha,alpha-trifluoro-p-toluoyl)methoxy]semicarbazide
SpectraBase Compound ID Ku5cYP8sDmb
InChI InChI=1S/C20H21F3N4O3S/c1-31-12-11-16(18(29)26-27-19(30)24-15-5-3-2-4-6-15)25-17(28)13-7-9-14(10-8-13)20(21,22)23/h2-10,16H,11-12H2,1H3,(H,25,28)(H,26,29)(H2,24,27,30)
InChIKey WKMKAOKYFUQIGD-UHFFFAOYSA-N
Mol Weight 454.47 g/mol
Molecular Formula C20H21F3N4O3S
Exact Mass 454.128646 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3e9opM8tcQi
Name 4-PHENYL-1-[N-(alpha,alpha,alpha-TRIFLUORO-p-TOLUOYL)METHIONYL]SEMICARBAZIDE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21F3N4O3S
InChI InChI=1S/C20H21F3N4O3S/c1-31-12-11-16(18(29)26-27-19(30)24-15-5-3-2-4-6-15)25-17(28)13-7-9-14(10-8-13)20(21,22)23/h2-10,16H,11-12H2,1H3,(H,25,28)(H,26,29)(H2,24,27,30)
InChIKey WKMKAOKYFUQIGD-UHFFFAOYSA-N
Melting Point 213-216C
Molecular Weight 454.47
Solvent Dimethyl sulfoxide-d6; Reference=TMS Spectrometer= Bruker AC-300
Synonyms SEMICARBAZIDE, 4-PHENYL-1-[N-(alpha,alpha,alpha-TRIFLUORO-p-TOLUOYL)METHIONYL]-,