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4-(4'-Hydroxy-phenyl)-2-butanone 4'-O-per-O-methyl.beta.-D-glucopyranoside
SpectraBase Compound ID LCIcWAdMhir
InChI InChI=1S/C20H30O7/c1-13(21)6-7-14-8-10-15(11-9-14)26-20-19(25-5)18(24-4)17(23-3)16(27-20)12-22-2/h8-11,16-20H,6-7,12H2,1-5H3/t16-,17-,18+,19-,20-/m1/s1
InChIKey QNOHZVZXFAQFOD-OUUBHVDSSA-N
Mol Weight 382.45 g/mol
Molecular Formula C20H30O7
Exact Mass 382.199153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9VAHcSkolGH
Name 4-(4'-Hydroxy-phenyl)-2-butanone 4'-O-per-O-methyl.beta.-D-glucopyranoside
CAS Registry Number 59282-60-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H30O7
InChI InChI=1S/C20H30O7/c1-13(21)6-7-14-8-10-15(11-9-14)26-20-19(25-5)18(24-4)17(23-3)16(27-20)12-22-2/h8-11,16-20H,6-7,12H2,1-5H3/t16-,17-,18+,19-,20-/m1/s1
InChIKey QNOHZVZXFAQFOD-OUUBHVDSSA-N
Instrument Name Bruker HX-90
Literature Reference A. Gonzalez, C.G. Francisco, Phytochem. 15, 344 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD3CN