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1-{[4-HYDROXY-3-(METHYLTHIO)-4,5,6,7-TETRAHYDROBENZO[c]THIEN-1-YL]-CARBONYL}-2-(alpha,alpha,alpha-TRIFLUORO-p-TOLUOYL)HYDRAZINE

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1-{[4-HYDROXY-3-(METHYLTHIO)-4,5,6,7-TETRAHYDROBENZO[c]THIEN-1-YL]-CARBONYL}-2-(alpha,alpha,alpha-TRIFLUORO-p-TOLUOYL)HYDRAZINE
SpectraBase Compound ID IPFgD6yhwLW
InChI InChI=1S/C18H17F3N2O3S2/c1-27-17-13-11(3-2-4-12(13)24)14(28-17)16(26)23-22-15(25)9-5-7-10(8-6-9)18(19,20)21/h5-8,12,24H,2-4H2,1H3,(H,22,25)(H,23,26)
InChIKey LEGQMLXYKNXJSK-UHFFFAOYSA-N
Mol Weight 430.46 g/mol
Molecular Formula C18H17F3N2O3S2
Exact Mass 430.063269 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BxMQIcSLgSl
Name 1-{[4-hydroxy-3-(methylthio)-4,5,6,7-tetrahydrobenzo[c]thien-1-yl]carbonyl}-2-(alpha,alpha,alpha-trifluoro-p-toluoyl)hydrazine
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17F3N2O3S2
InChI InChI=1S/C18H17F3N2O3S2/c1-27-17-13-11(3-2-4-12(13)24)14(28-17)16(26)23-22-15(25)9-5-7-10(8-6-9)18(19,20)21/h5-8,12,24H,2-4H2,1H3,(H,22,25)(H,23,26)
InChIKey LEGQMLXYKNXJSK-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 61255M
Solvent CDCl3