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[4-S-(4A-ALPHA,5-BETA,6-ALPHA,7A-ALPHA,7B-BETA)]-4,4A,5,6,7A,7B-HEXAHYDRO-4,5-DIHYDROXY-6-[(HYDROXY)-METHYL]-2H-1,7-DIOXACYCLOPENT-[CD]-INDENE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

[4-S-(4A-ALPHA,5-BETA,6-ALPHA,7A-ALPHA,7B-BETA)]-4,4A,5,6,7A,7B-HEXAHYDRO-4,5-DIHYDROXY-6-[(HYDROXY)-METHYL]-2H-1,7-DIOXACYCLOPENT-[CD]-INDENE
SpectraBase Compound ID DiyYXu5qo17
InChI InChI=1S/C10H14O5/c11-2-6-9(13)8-5(12)1-4-3-14-10(15-6)7(4)8/h1,5-13H,2-3H2/t5-,6+,7+,8-,9+,10-/m0/s1
InChIKey QNUDUBFDUZCLJD-DLXYEPTOSA-N
Mol Weight 214.22 g/mol
Molecular Formula C10H14O5
Exact Mass 214.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KCFGqLth0FC
Name [4S-(4a.alpha.,5.alpha.,6.beta.,7a.alpha.,7b.alpha.)]-4,5-(Dihydroxy)-6-[(hydroxy)methyl]-4,4a,5,6,7a,7b-hexahydro-2H-1,7-dioxacyclopent[cd]indene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O5
InChI InChI=1S/C10H14O5/c11-2-6-9(13)8-5(12)1-4-3-14-10(15-6)7(4)8/h1,5-13H,2-3H2/t5-,6+,7+,8-,9+,10-/m0/s1
InChIKey QNUDUBFDUZCLJD-DLXYEPTOSA-N
Molecular Weight 214.217 g/mol
SMILES O[C@]1(C=C2[C@]3([C@](O[C@](CO)([C@]([C@@]13[H])(O)[H])[H])(OC2)[H])[H])[H]
SPLASH splash10-004i-9200000000-f54aabfbe8e2ddfc3e04
Source of Spectrum J-64-8309-8
Synonyms (4aR,5S,6R,7aS,7bS)-6-(hydroxymethyl)-4,4a,5,6,7a,7b-hexahydro-2H-1,7-dioxacyclopenta[cd]indene-4,5-diol [4S-(4a.alpha.,5.beta.,6.alpha.,7a.alpha.,7b.alpha.)]-4,5-(Dihydroxy)-6-[(hydroxy)methyl]-4,4a,5,6,7a,7b-hexahydro-2H-1,7-dioxacyclopent[cd]indene
Wiley ID 1531432