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(1S,4R)-4-Acetoxy-5,5-dimethyl-2-cyclopentene-1-ol
SpectraBase Compound ID 70t4GHp4MND
InChI InChI=1S/C9H14O3/c1-6(10)12-8-5-4-7(11)9(8,2)3/h4-5,7-8,11H,1-3H3/t7-,8+/m0/s1
InChIKey KWRCXTGFXIDOSH-JGVFFNPUSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F0SWbDrCK7H
Name (1S,4R)-4-Acetoxy-5,5-dimethyl-2-cyclopentene-1-ol
Alternate Name(s) (1R,4S)-4-hydroxy-5,5-dimethyl-2-cyclopenten-1-yl acetate acetic acid[(1R,4S)-4-hydroxy-5,5-dimethyl-1-cyclopent-2-enyl]ester acetic acid[(1R,4S)-4-hydroxy-5,5-dimethyl-cyclopent-2-en-1-yl]ester [(1R,4S)-4-hydroxy-5,5-dimethyl-cyclopent-2-en-1-yl]acetate [(1R,4S)-5,5-dimethyl-4-oxidanyl-cyclopent-2-en-1-yl]ethanoate acetic acid [(1R,4S)-4-hydroxy-5,5-dimethyl-1-cyclopent-2-enyl] ester [(1R,4S)-4-hydroxy-5,5-dimethylcyclopent-2-en-1-yl] acetate [(1R,4S)-4-hydroxy-5,5-dimethyl-cyclopent-2-en-1-yl] acetate [(1R,4S)-5,5-dimethyl-4-oxidanyl-cyclopent-2-en-1-yl] ethanoate
Comments Less than 3 mono-isotopic peaks
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Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-6(10)12-8-5-4-7(11)9(8,2)3/h4-5,7-8,11H,1-3H3/t7-,8+/m0/s1
InChIKey KWRCXTGFXIDOSH-JGVFFNPUSA-N
Molecular Weight 170.208 g/mol
SMILES O[C@]1(C=C[C@](C1(C)C)(OC(=O)C)[H])[H]
SPLASH splash10-0002-9100000000-f8a52b6bd727a3b2f97a
Source of Spectrum QC-6-589-3
Wiley ID 868693