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1,4-Naphthalenedione, 5-methoxy-2-(2-propenyl)-3-[1-[(tetrahydro-2H-pyran-2-yl)oxy]butyl]-
SpectraBase Compound ID BhHkOMQuCL6
InChI InChI=1S/C23H28O5/c1-4-9-15-21(18(10-5-2)28-19-13-6-7-14-27-19)23(25)20-16(22(15)24)11-8-12-17(20)26-3/h4,8,11-12,18-19H,1,5-7,9-10,13-14H2,2-3H3
InChIKey PZJXLRJJZHBNCI-UHFFFAOYSA-N
Mol Weight 384.47 g/mol
Molecular Formula C23H28O5
Exact Mass 384.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9LauXV3kzVo
Name 1,4-Naphthalenedione, 5-methoxy-2-(2-propenyl)-3-[1-[(tetrahydro-2H-pyran-2-yl)oxy]butyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 384.193673997 u
Formula C23H28O5
InChI InChI=1S/C23H28O5/c1-4-9-15-21(18(10-5-2)28-19-13-6-7-14-27-19)23(25)20-16(22(15)24)11-8-12-17(20)26-3/h4,8,11-12,18-19H,1,5-7,9-10,13-14H2,2-3H3
InChIKey PZJXLRJJZHBNCI-UHFFFAOYSA-N
Molecular Weight 384.472 g/mol
SMILES C1(=C(C(=O)C2=C(C1=O)C(OC)=CC=C2)CC=C)C(OC1OCCCC1)CCC