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(3aR,9aR)-9a-methyl-2,3,3a,4-tetrahydrofuro[2,3-b]chromene-5,7-diol
SpectraBase Compound ID 9c3WWS7JpaW
InChI InChI=1S/C12H14O4/c1-12-7(2-3-15-12)4-9-10(14)5-8(13)6-11(9)16-12/h5-7,13-14H,2-4H2,1H3/t7-,12+/m0/s1
InChIKey ZVHMUEUOORJHSH-JVXZTZIISA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JMTqsEJTOeW
Name rac-5-Demethylxylomonoketal
Alternate Name(s) (3aR,9aR)-9a-methyl-2,3,3a,4-tetrahydrofuro[2,3-b][1]benzopyran-5,7-diol
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Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-12-7(2-3-15-12)4-9-10(14)5-8(13)6-11(9)16-12/h5-7,13-14H,2-4H2,1H3/t7-,12+/m0/s1
InChIKey ZVHMUEUOORJHSH-JVXZTZIISA-N
Molecular Weight 222.240 g/mol
SMILES Oc1cc2O[C@@]3([C@](Cc2c(c1)O)(CCO3)[H])C
SPLASH splash10-001l-9100000000-db519cd5173d03a64409
Source of Spectrum K1-2004-1268-18
Wiley ID 1560566