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rel-(1S,3R,4R)-4-Hydroxy-5,6,8-trimethoxy-1,3-dimethyl-2-benzopyran
SpectraBase Compound ID 50S74Rg7vK
InChI InChI=1S/C14H20O5/c1-7-11-9(16-3)6-10(17-4)14(18-5)12(11)13(15)8(2)19-7/h6-8,13,15H,1-5H3/t7-,8+,13-/m0/s1
InChIKey MGPIRUVEIABOCN-DAROEXNTSA-N
Mol Weight 268.31 g/mol
Molecular Formula C14H20O5
Exact Mass 268.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iwz2TC0b1YO
Name rel-(1S,3R,4R)-4-Hydroxy-5,6,8-trimethoxy-1,3-dimethyl-2-benzopyran
Appearance Light yellow oil
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Formula C14H20O5
InChI InChI=1S/C14H20O5/c1-7-11-9(16-3)6-10(17-4)14(18-5)12(11)13(15)8(2)19-7/h6-8,13,15H,1-5H3/t7-,8+,13-/m0/s1
InChIKey MGPIRUVEIABOCN-DAROEXNTSA-N
Instrument Name Finnigan-MAT GCQ
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0011.206
Molecular Weight 268.309 g/mol
SMILES O[C@]1([C@](O[C@](c2c(cc(c(c12)OC)OC)OC)(C)[H])(C)[H])[H]
SPLASH splash10-0udi-0190000000-0c6369f3ca370441a091
Source of Spectrum ARK-2010-93-40
Wiley ID 1866845