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1-(3',5'-Dimethoxy-2'-formylphenyl)tridecan-2-yl acetate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-(3',5'-Dimethoxy-2'-formylphenyl)tridecan-2-yl acetate
SpectraBase Compound ID 89DY0nahFGQ
InChI InChI=1S/C24H38O5/c1-5-6-7-8-9-10-11-12-13-14-21(29-19(2)26)15-20-16-22(27-3)17-24(28-4)23(20)18-25/h16-18,21H,5-15H2,1-4H3
InChIKey FMOYSNZRTCTKPK-UHFFFAOYSA-N
Mol Weight 406.6 g/mol
Molecular Formula C24H38O5
Exact Mass 406.271924 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LhAB0G84gWx
Name 1-(3',5'-Dimethoxy-2'-formylphenyl)tridecan-2-yl acetate
Comments Computed using HOSE algorithm
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Exact Mass 406.271924319 u
Formula C24H38O5
InChI InChI=1S/C24H38O5/c1-5-6-7-8-9-10-11-12-13-14-21(29-19(2)26)15-20-16-22(27-3)17-24(28-4)23(20)18-25/h16-18,21H,5-15H2,1-4H3
InChIKey FMOYSNZRTCTKPK-UHFFFAOYSA-N
Molecular Weight 406.563 g/mol
SMILES C=1(C(=C(OC)C=C(C1)OC)C=O)CC(OC(=O)C)CCCCCCCCCCC