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(1R,2aS,8bR)-2a-hydroxy-2,3,4,8b-tetrahydro-1H-cyclobuta[a]naphthalene-1-carboxylic acid methyl ester
SpectraBase Compound ID CkuKvL9cwYg
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-DYEKYZERSA-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 8pT7EwlZVwE
Name (1R,2aS,8bR)-2a-hydroxy-2,3,4,8b-tetrahydro-1H-cyclobuta[a]naphthalene-1-carboxylic acid methyl ester
Alternate Name(s) methyl (1R,2aS,8bR)-2a-hydroxy-2,3,4,8b-tetrahydro-1H-cyclobuta[a]naphthalene-1-carboxylate methyl (1R,2aS,8bR)-2a-oxidanyl-2,3,4,8b-tetrahydro-1H-cyclobuta[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-DYEKYZERSA-N
Molecular Weight 232.279 g/mol
SMILES O[C@]12[C@](c3ccccc3CC2)([H])[C@@](C1)(C(=O)OC)[H]
SPLASH splash10-0002-0900000000-41364a721d04b94bdbf5
Source of Spectrum KC-0-56-10
Wiley ID 782938