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4,4a,5,6,7,7a.alpha.,8,9-octahydro-5.beta.-hydroxy-4a.beta.,8.beta.-dimethylazuleno[6,5-b]furan-3-carboxilic Acid
SpectraBase Compound ID GJwsaiudvVb
InChI InChI=1S/C15H20O4/c1-8-5-12-9(10(7-19-12)14(17)18)6-15(2)11(8)3-4-13(15)16/h7-8,11,13,16H,3-6H2,1-2H3,(H,17,18)/t8-,11?,13-,15-/m0/s1
InChIKey LRMLGJFMGVBYHW-QSCADAGQSA-N
Mol Weight 264.32 g/mol
Molecular Formula C15H20O4
Exact Mass 264.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57JGa1zh5Hy
Name 4,4a,5,6,7,7a.alpha.,8,9-octahydro-5.beta.-hydroxy-4a.beta.,8.beta.-dimethylazuleno[6,5-b]furan-3-carboxilic Acid
CAS Registry Number 83097-05-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O4
InChI InChI=1S/C15H20O4/c1-8-5-12-9(10(7-19-12)14(17)18)6-15(2)11(8)3-4-13(15)16/h7-8,11,13,16H,3-6H2,1-2H3,(H,17,18)/t8-,11?,13-,15-/m0/s1
InChIKey LRMLGJFMGVBYHW-QSCADAGQSA-N
Molecular Weight 264.321 g/mol
SMILES O[C@@]1([C@@]2(C([C@](Cc3c(c(C(=O)O)co3)C2)(C)[H])CC1)C)[H]
SPLASH splash10-01ta-0490000000-cb83b3f7740804a59cf9
Source of Spectrum C-108-1062-19
Synonyms (4aS,5S,8S)-5-hydroxy-4a,8-dimethyl-4,4a,5,6,7,7a,8,9-octahydroazuleno[6,5-b]furan-3-carboxylic acid
Wiley ID 1267971