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1H-2-Benzopyran-1-one, 3,4-dihydro-6,8-dimethoxy-3,4-dimethyl-, cis-(.+-.)-
SpectraBase Compound ID 9Cegvoo2xyn
InChI InChI=1S/C13H16O4/c1-7-8(2)17-13(14)12-10(7)5-9(15-3)6-11(12)16-4/h5-8H,1-4H3/t7-,8+/m1/s1
InChIKey DIADRSXVCZFRDA-SFYZADRCSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BRmjEV9FNUh
Name 1H-2-Benzopyran-1-one, 3,4-dihydro-6,8-dimethoxy-3,4-dimethyl-, cis-(.+-.)-
Alternate Name(s) (3S,4S)-6,8-dimethoxy-3,4-dimethyl-3,4-dihydro-1H-2-benzopyran-1-one 2-oxa-3,4-erythro-dimethyl-6,8-dimethoxy-3,4-dihydro-naphthalen-1-one
CAS Registry Number 110087-18-8
Comments Less than 3 mono-isotopic peaks
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Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-7-8(2)17-13(14)12-10(7)5-9(15-3)6-11(12)16-4/h5-8H,1-4H3/t7-,8+/m1/s1
InChIKey DIADRSXVCZFRDA-SFYZADRCSA-N
Molecular Weight 236.267 g/mol
SMILES c12C(O[C@]([C@](c2cc(cc1OC)OC)(C)[H])(C)[H])=O
SPLASH splash10-000f-0970000000-77c237698b47b268b821
Source of Spectrum KC-1986-2104-12
Wiley ID 1238084