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Rosellisin

View entire compound with spectra: 4 NMR

Rosellisin
SpectraBase Compound ID 3IMetrexovu
InChI InChI=1S/C12H14O7/c1-17-10(15)4-3-9-7(5-13)11(18-2)8(6-14)12(16)19-9/h3-4,13-14H,5-6H2,1-2H3/b4-3+
InChIKey UWAPCCUFQCTXOV-ONEGZZNKSA-N
Mol Weight 270.24 g/mol
Molecular Formula C12H14O7
Exact Mass 270.073953 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4DMZQV5Kox9
Name Rosellisin
CAS Registry Number 61486-68-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H14O7
InChI InChI=1S/C12H14O7/c1-17-10(15)4-3-9-7(5-13)11(18-2)8(6-14)12(16)19-9/h3-4,13-14H,5-6H2,1-2H3/b4-3+
InChIKey UWAPCCUFQCTXOV-ONEGZZNKSA-N
Instrument Name Jeol PS-100
Literature Reference M.S. Nair, Phytochem. 15, 1090 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6