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Methyl 15-(5,6-dimethoxy-1,4-benzoquinon-2-yl)pentadecanoate

View entire compound with spectra: 1 NMR

Methyl 15-(5,6-dimethoxy-1,4-benzoquinon-2-yl)pentadecanoate
SpectraBase Compound ID L0QoAh7aCfN
InChI InChI=1S/C24H38O6/c1-28-21(26)17-15-13-11-9-7-5-4-6-8-10-12-14-16-19-18-20(25)23(29-2)24(30-3)22(19)27/h18H,4-17H2,1-3H3
InChIKey USQOBEGVTFRNQV-UHFFFAOYSA-N
Mol Weight 422.6 g/mol
Molecular Formula C24H38O6
Exact Mass 422.266839 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KmUkqDLRiJB
Name Methyl 15-(5,6-dimethoxy-1,4-benzoquinon-2-yl)pentadecanoate
Comments Computed using HOSE algorithm
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Exact Mass 422.266838938 u
Formula C24H38O6
InChI InChI=1S/C24H38O6/c1-28-21(26)17-15-13-11-9-7-5-4-6-8-10-12-14-16-19-18-20(25)23(29-2)24(30-3)22(19)27/h18H,4-17H2,1-3H3
InChIKey USQOBEGVTFRNQV-UHFFFAOYSA-N
Molecular Weight 422.562 g/mol
SMILES C1(=C(C(C(=CC1=O)CCCCCCCCCCCCCCC(OC)=O)=O)OC)OC