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(4a,1-trans)-2,3,4,4a,9,9a-Hexahydro-1H-xanthene-1,5-diol

View entire compound with spectra: 1 MS (GC)

(4a,1-trans)-2,3,4,4a,9,9a-Hexahydro-1H-xanthene-1,5-diol
SpectraBase Compound ID JajV7gmnWvd
InChI InChI=1S/C13H16O3/c14-10-4-2-6-12-9(10)7-8-3-1-5-11(15)13(8)16-12/h1,3,5,9-10,12,14-15H,2,4,6-7H2/t9?,10-,12+/m0/s1
InChIKey BDKPPUNKPBKSHX-OJBNZGHXSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LG5KxuaNSum
Name (4a,1-trans)-2,3,4,4a,9,9a-Hexahydro-1H-xanthene-1,5-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O3
InChI InChI=1S/C13H16O3/c14-10-4-2-6-12-9(10)7-8-3-1-5-11(15)13(8)16-12/h1,3,5,9-10,12,14-15H,2,4,6-7H2/t9?,10-,12+/m0/s1
InChIKey BDKPPUNKPBKSHX-OJBNZGHXSA-N
Molecular Weight 220.268 g/mol
SMILES Oc1cccc2c1O[C@]1(C([C@](CCC1)(O)[H])C2)[H]
SPLASH splash10-00di-0590000000-74f00440b742e38e56cc
Source of Spectrum U1-2009-5581-4a
Wiley ID 1697314