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VMEJANRODATDOF-UHFFFAOYSA-N

View entire compound with spectra: 9 NMR, and 2 MS (GC)

VMEJANRODATDOF-UHFFFAOYSA-N
SpectraBase Compound ID 2jndaq7lMV
InChI InChI=1S/C21H16O7/c1-24-15-6-11-12(7-16(15)25-2)20(22)13-8-26-21(23)19(13)18(11)10-3-4-14-17(5-10)28-9-27-14/h3-7,22H,8-9H2,1-2H3
InChIKey VMEJANRODATDOF-UHFFFAOYSA-N
Mol Weight 380.35 g/mol
Molecular Formula C21H16O7
Exact Mass 380.089603 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6AdQORhMh0z
Name Diphyllin
CAS Registry Number 22055-22-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H16O7
InChI InChI=1S/C21H16O7/c1-24-15-6-11-12(7-16(15)25-2)20(22)13-8-26-21(23)19(13)18(11)10-3-4-14-17(5-10)28-9-27-14/h3-7,22H,8-9H2,1-2H3
InChIKey VMEJANRODATDOF-UHFFFAOYSA-N
Literature Reference P.K. Agrawal, R.S. Thakur, Magn. Res. Chem. 23, 389 (1985).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3