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QDPFEHQBCNSIRV-QSOLLTQBSA-N

View entire compound with spectra: 2 NMR

QDPFEHQBCNSIRV-QSOLLTQBSA-N
SpectraBase Compound ID 2jHUzZzZN6a
InChI InChI=1S/C20H22O4/c1-13(6-5-7-14(2)10-19(21)22)8-9-17-16(4)15(3)11-18-20(17)24-12-23-18/h5-11H,12H2,1-4H3,(H,21,22)/b7-5+,9-8+,13-6+,14-10+
InChIKey QDPFEHQBCNSIRV-QSOLLTQBSA-N
Mol Weight 326.39 g/mol
Molecular Formula C20H22O4
Exact Mass 326.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 52URwaKIeeH
Name 9-(5,6-Dioxymethylene-2,3-dimethyl-phenyl)-3,7-dimethyl-nonatetraenoic acid
CAS Registry Number 75783-03-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H22O4
InChI InChI=1S/C20H22O4/c1-13(6-5-7-14(2)10-19(21)22)8-9-17-16(4)15(3)11-18-20(17)24-12-23-18/h5-11H,12H2,1-4H3,(H,21,22)/b7-5+,9-8+,13-6+,14-10+
InChIKey QDPFEHQBCNSIRV-QSOLLTQBSA-N
Instrument Name Bruker HX-90
Literature Reference G. Englert, Helv. Chim. Acta 58, 2367 (1975).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3