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Cumarin

View entire compound with spectra: 129 NMR, 14 FTIR, 3 Raman, 1 UV-Vis, and 37 MS (GC)

Cumarin
SpectraBase Compound ID 2V3RRqFc4oX
InChI InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H
InChIKey ZYGHJZDHTFUPRJ-UHFFFAOYSA-N
Mol Weight 146.14 g/mol
Molecular Formula C9H6O2
Exact Mass 146.036779 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 26nxtiFmN4k
Name COUMARIN
CAS Registry Number 91-64-5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H6O2
InChI InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H
InChIKey ZYGHJZDHTFUPRJ-UHFFFAOYSA-N
Literature Reference Author H.DUDDECK,M.KAISER
Literature Reference Citation ORG.MAGN.RES.,20,55(1982)
Literature Reference DOI 10.1002/mrc.1270200202
Molecular Weight 146.145 g/mol
Solvent CDCl3
Source File Reference UNIW5468