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7-benzyloxy-6-[(2R)-2,3-dihydroxy-3-methyl-butyl]-8-(dimethoxymethyl)chromen-2-one
SpectraBase Compound ID 276kRA8DGNP
InChI InChI=1S/C24H28O7/c1-24(2,27)18(25)13-17-12-16-10-11-19(26)31-22(16)20(23(28-3)29-4)21(17)30-14-15-8-6-5-7-9-15/h5-12,18,23,25,27H,13-14H2,1-4H3/t18-/m1/s1
InChIKey NMQUWJVDRKLCGH-GOSISDBHSA-N
Mol Weight 428.48 g/mol
Molecular Formula C24H28O7
Exact Mass 428.183503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AQAKm6GOWXN
Name 7-benzyloxy-6-[(2R)-2,3-dihydroxy-3-methyl-butyl]-8-(dimethoxymethyl)chromen-2-one
Appearance Oil
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Exact Mass 428.183503235 u
Formula C24H28O7
InChI InChI=1S/C24H28O7/c1-24(2,27)18(25)13-17-12-16-10-11-19(26)31-22(16)20(23(28-3)29-4)21(17)30-14-15-8-6-5-7-9-15/h5-12,18,23,25,27H,13-14H2,1-4H3/t18-/m1/s1
InChIKey NMQUWJVDRKLCGH-GOSISDBHSA-N
Instrument Name GenTech 5890 Series II SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201601370
Molecular Weight 428.481 g/mol
Optical Rotation [a]D20 = +23.3 (c = 0.45, MeOH)
Quality 127
Reported Formula C24H28O7
SMILES O[C@@](C(C)(O)C)(CC=1C(OCC2=CC=CC=C2)=C(C2=C(C1)C=CC(O2)=O)C(OC)OC)[H]
SPLASH splash10-0002-0092000000-00bdc6cecac9b2f5cb7c
Source of Spectrum QE-22-SM27-26 (DOI: 10.1002/chem.201601370)
Wiley ID 1903439