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rel-(5R,6S,10S)-6-[2-((methylsulfonyl)oxy)ethyl]-6,10-dimethylspiro[4.5]deca-3,7-dien-2-one
SpectraBase Compound ID 6JcwH5Oqj3m
InChI InChI=1S/C15H22O4S/c1-12-5-4-7-14(2,9-10-19-20(3,17)18)15(12)8-6-13(16)11-15/h4,6-8,12H,5,9-11H2,1-3H3/t12-,14+,15+/m0/s1
InChIKey UVLRBIJWPWMJHO-NWANDNLSSA-N
Mol Weight 298.4 g/mol
Molecular Formula C15H22O4S
Exact Mass 298.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 49zclF1tZrM
Name rel-(5R,6S,10S)-6-[2-((methylsulfonyl)oxy)ethyl]-6,10-dimethylspiro[4.5]deca-3,7-dien-2-one
CAS Registry Number 113353-13-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O4S
InChI InChI=1S/C15H22O4S/c1-12-5-4-7-14(2,9-10-19-20(3,17)18)15(12)8-6-13(16)11-15/h4,6-8,12H,5,9-11H2,1-3H3/t12-,14+,15+/m0/s1
InChIKey UVLRBIJWPWMJHO-NWANDNLSSA-N
Molecular Weight 298.397 g/mol
SMILES C(OS(=O)(=O)C)C[C@@]1([C@@]2(C=CC(C2)=O)[C@@](C)(CC=C1)[H])C
SPLASH splash10-0006-9300000000-352cce143209c2fdf115
Source of Spectrum J-53-1627-19
Synonyms 2-[(5R,6S,10S)-6,10-dimethyl-3-oxospiro[4.5]deca-1,7-dien-6-yl]ethyl methanesulfonate
Wiley ID 1300732