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9-DEOXYGONIOPYPYRONE
SpectraBase Compound ID 8BtXG2xDirV
InChI InChI=1S/C13H14O4/c14-11-7-9-6-10(17-11)12(15)13(16-9)8-4-2-1-3-5-8/h1-5,9-10,12-13,15H,6-7H2/t9-,10-,12+,13+/m1/s1
InChIKey ZPVLUTBGTWEMGV-AAXDQBDMSA-N
Mol Weight 234.25 g/mol
Molecular Formula C13H14O4
Exact Mass 234.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ODbuTxiyG
Name 9-Deoxy-goniopyrone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O4
InChI InChI=1S/C13H14O4/c14-11-7-9-6-10(17-11)12(15)13(16-9)8-4-2-1-3-5-8/h1-5,9-10,12-13,15H,6-7H2/t9-,10-,12+,13+/m1/s1
InChIKey ZPVLUTBGTWEMGV-AAXDQBDMSA-N
Molecular Weight 234.251 g/mol
SMILES O[C@]1([C@@]2(OC(=O)C[C@](O[C@]1(c1ccccc1)[H])(C2)[H])[H])[H]
SPLASH splash10-056u-9800000000-ea92ae3cab35be398b9e
Source of Spectrum X2-54-1039-1
Synonyms (1R,3S,4S,5R)-4-oxidanyl-3-phenyl-2,6-dioxabicyclo[3.3.1]nonan-7-one
Wiley ID 1604140