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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

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 6oNQf21Vn2t
Name 1,2-DI-3-PYRIDYL-2-METHYL-1-PROPANONE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number 85652-5
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. 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
Melting Point 53-56C
Molecular Weight 226.279007
Synonyms 1-PROPANONE, 1,2-DI-3-PYRIDYL- 2-METHYL-,
Technique CAPILLARY CELL: MELT (CRYSTALLINE PHASE)