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9OLzkCwfWGg
spectrumID
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9OLzkCwfWGg
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analyticalTechnique
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19F NMR
analyticalTechniqueLongName
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19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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1-(BENZOXAZOL-2-YLTHIO)-1-PHENYL-2,2,2-TRIFLUOROETHYLISOCYANATE
SpectraBase Compound ID GtzgYuTGvxI
InChI InChI=1S/C16H9F3N2O2S/c17-16(18,19)15(20-10-22,11-6-2-1-3-7-11)24-14-21-12-8-4-5-9-13(12)23-14/h1-9H
InChIKey ZVISBLKUGCIGHA-UHFFFAOYSA-N
Mol Weight 350.32 g/mol
Molecular Formula C16H9F3N2O2S
Exact Mass 350.033683 g/mol
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19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9OLzkCwfWGg
Name 1-(BENZOXAZOL-2-YLTHIO)-1-PHENYL-2,2,2-TRIFLUOROETHYLISOCYANATE
Comments SCALE INVERTED;WP-200 (BRUKER)
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C16H9F3N2O2S
InChI InChI=1S/C16H9F3N2O2S/c17-16(18,19)15(20-10-22,11-6-2-1-3-7-11)24-14-21-12-8-4-5-9-13(12)23-14/h1-9H
InChIKey ZVISBLKUGCIGHA-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference M.V.VOVK, YU.N.DAVIDYUK, L.I.SAMARAI (1991) Zhurn.Org.Khim.(Russ. Lang.): v.27,N7, 1480-1486.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6
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