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5-(2-HYDROXY-3-METHOXY-3-METHYLBUTOXY)-PSORALEN

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5-(2-HYDROXY-3-METHOXY-3-METHYLBUTOXY)-PSORALEN
SpectraBase Compound ID JHE4RcMpDD4
InChI InChI=1S/C17H18O6/c1-17(2,20-3)14(18)9-22-16-10-4-5-15(19)23-13(10)8-12-11(16)6-7-21-12/h4-8,14,18H,9H2,1-3H3
InChIKey UHENVVIVPZCJOA-UHFFFAOYSA-N
Mol Weight 318.33 g/mol
Molecular Formula C17H18O6
Exact Mass 318.110338 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B1ZbHFN6F1c
Name Oxypeucedanin hydrate methyl ether
CAS Registry Number 35930-26-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H18O6
InChI InChI=1S/C17H18O6/c1-17(2,20-3)14(18)9-22-16-10-4-5-15(19)23-13(10)8-12-11(16)6-7-21-12/h4-8,14,18H,9H2,1-3H3
InChIKey UHENVVIVPZCJOA-UHFFFAOYSA-N
Instrument Name Bruker AM-400
Literature Reference F.A. Macias, G.M. Massanet, F. Rodriguez-Luis, Magn. Res. Chem. 28, 219 (1990).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3