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(1S,4aR)-2,3,4,4a-Tetrahydro-1H-xanthene-1,5-diol
SpectraBase Compound ID FgI2IiO3Csr
InChI InChI=1S/C13H14O3/c14-10-4-2-6-12-9(10)7-8-3-1-5-11(15)13(8)16-12/h1,3,5,7,10,12,14-15H,2,4,6H2/t10-,12+/m0/s1
InChIKey PPEJXNAACQZSFC-CMPLNLGQSA-N
Mol Weight 218.25 g/mol
Molecular Formula C13H14O3
Exact Mass 218.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6z0HkOgRiyp
Name (1S,4aR)-2,3,4,4a-Tetrahydro-1H-xanthene-1,5-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O3
InChI InChI=1S/C13H14O3/c14-10-4-2-6-12-9(10)7-8-3-1-5-11(15)13(8)16-12/h1,3,5,7,10,12,14-15H,2,4,6H2/t10-,12+/m0/s1
InChIKey PPEJXNAACQZSFC-CMPLNLGQSA-N
Molecular Weight 218.252 g/mol
SMILES O[C@@]1(C=2[C@](Oc3c(cccc3C2)O)(CCC1)[H])[H]
SPLASH splash10-014j-0980000000-57062c3b66ae928d7834
Source of Spectrum U1-2009-5581-3a
Wiley ID 1697317