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(+-)Methyl (1.alpha.,2a.beta.,8b.beta.)-2a-Hydroxy-1,2,2a,3,4,8b-hexahydrocyclobuta[a]naphthalene-1-carboxylate
SpectraBase Compound ID p2KaxgsUkc
InChI InChI=1S/C14H16O3/c1-17-13(15)11-8-14(16)7-6-9-4-2-3-5-10(9)12(11)14/h2-5,11-12,16H,6-8H2,1H3/t11-,12-,14-/m1/s1
InChIKey WNJYJHMPDQFONV-YRGRVCCFSA-N
Mol Weight 232.28 g/mol
Molecular Formula C14H16O3
Exact Mass 232.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ICa5BjgQabc
Name (+-)Methyl (1.alpha.,2a.beta.,8b.beta.)-2a-Hydroxy-1,2,2a,3,4,8b-hexahydrocyclobuta[a]naphthalene-1-carboxylate
Alternate Name(s) methyl (1R,2aR,8bS)-2a-hydroxy-1,2,2a,3,4,8b-hexahydrocyclobuta[a]naphthalene-1-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C14H16O3
InChI InChI=1S/C14H16O3/c1-17-13(15)11-8-14(16)7-6-9-4-2-3-5-10(9)12(11)14/h2-5,11-12,16H,6-8H2,1H3/t11-,12-,14-/m1/s1
InChIKey WNJYJHMPDQFONV-YRGRVCCFSA-N
Molecular Weight 232.279 g/mol
SMILES O[C@@]12[C@@](c3ccccc3CC2)([H])[C@@](C1)(C(=O)OC)[H]
SPLASH splash10-0002-0910000000-e1808528e02a8cfd701d
Source of Spectrum KC-0-56-11
Wiley ID 782937