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(3S,5R,6S)-6-hydroxy-3-phenylspiro[4.5]decane-1,7-dione
SpectraBase Compound ID IinDuOuEBIf
InChI InChI=1S/C16H18O3/c17-13-7-4-8-16(15(13)19)10-12(9-14(16)18)11-5-2-1-3-6-11/h1-3,5-6,12,15,19H,4,7-10H2/t12-,15-,16+/m1/s1
InChIKey BAHIRSTYRGDKLR-WQVCFCJDSA-N
Mol Weight 258.32 g/mol
Molecular Formula C16H18O3
Exact Mass 258.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6YlCT4hNGtM
Name (3S,5R,6S)-6-hydroxy-3-phenylspiro[4.5]decane-1,7-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O3
InChI InChI=1S/C16H18O3/c17-13-7-4-8-16(15(13)19)10-12(9-14(16)18)11-5-2-1-3-6-11/h1-3,5-6,12,15,19H,4,7-10H2/t12-,15-,16+/m1/s1
InChIKey BAHIRSTYRGDKLR-WQVCFCJDSA-N
Literature Reference DOI 10.1002/asia.201100383
Molecular Weight 258.317 g/mol
SMILES O[C@@]1(C(=O)CCC[C@]11C(=O)C[C@](C1)(c1ccccc1)[H])[H]
SPLASH splash10-052f-8980000000-812269554d578a9e3c25
Source of Spectrum CAJ-6-2269/SM7-5b
Wiley ID 1773102