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(1R)-5.beta.,6.beta.-Dihydroxycineole acetonide
SpectraBase Compound ID DoDaD2h0oxt
InChI InChI=1S/C13H22O3/c1-11(2)8-6-7-13(5,16-11)10-9(8)14-12(3,4)15-10/h8-10H,6-7H2,1-5H3/t8-,9-,10-,13+/m0/s1
InChIKey QNNQNUWFEXLBEV-AVWBDOJWSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GuGKKcimdOE
Name (1R)-5.beta.,6.beta.-Dihydroxycineole acetonide
Alternate Name(s) (3aS,4R,7S)-2,2,4,8,8-pentamethylhexahydro-4,7-(epoxymethano)benzo[d][1,3]dioxole
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Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-11(2)8-6-7-13(5,16-11)10-9(8)14-12(3,4)15-10/h8-10H,6-7H2,1-5H3/t8-,9-,10-,13+/m0/s1
InChIKey QNNQNUWFEXLBEV-AVWBDOJWSA-N
Molecular Weight 226.316 g/mol
SMILES [C@]12([C@]([C@]3(C(C)(C)O[C@@]2(CC3)C)[H])(OC(O1)(C)C)[H])[H]
SPLASH splash10-0f6x-9400000000-e7bcd5cb210d74351874
Source of Spectrum QC-24-331-19
Wiley ID 1738839