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Metyrapone

View entire compound with spectra: 6 NMR, 5 FTIR, and 13 MS (GC)

Metyrapone
SpectraBase Compound ID 5s8HmM2qJD8
InChI InChI=1S/C14H14N2O/c1-14(2,12-6-4-8-16-10-12)13(17)11-5-3-7-15-9-11/h3-10H,1-2H3
InChIKey FJLBFSROUSIWMA-UHFFFAOYSA-N
Mol Weight 226.28 g/mol
Molecular Formula C14H14N2O
Exact Mass 226.110613 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ssgjb1jyae
Name METOPIRON,(METYRAPONE)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H14N2O
InChI InChI=1S/C14H14N2O/c1-14(2,12-6-4-8-16-10-12)13(17)11-5-3-7-15-9-11/h3-10H,1-2H3
InChIKey FJLBFSROUSIWMA-UHFFFAOYSA-N
Literature Reference Author W.ROBIEN,I.ZOLLE
Literature Reference Citation INT.J.APPL.RAD.,34,907(1983)
Literature Reference DOI 10.1016/0020-708x(83)90153-9
Molecular Weight 226.278 g/mol
Solvent CDCl3
Source File Reference UNIW6915