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3,7-Dimethyl-11-(hydroxyethylthiomethyl)bicyclo[8.3.0]dodeca-2,6-dien-12-one
SpectraBase Compound ID yfv4rquNLk
InChI InChI=1S/C17H26O3S/c1-12-4-3-5-13(2)10-16-14(7-6-12)15(17(19)20-16)11-21-9-8-18/h4,10,14-16,18H,3,5-9,11H2,1-2H3/b12-4+,13-10+/t14-,15-,16+/m0/s1
InChIKey MAKVSGSSYQDQDH-PPPQSOSOSA-N
Mol Weight 310.45 g/mol
Molecular Formula C17H26O3S
Exact Mass 310.160266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EO2DXmDZcBg
Name 3,7-Dimethyl-11-(hydroxyethylthiomethyl)bicyclo[8.3.0]dodeca-2,6-dien-12-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O3S
InChI InChI=1S/C17H26O3S/c1-12-4-3-5-13(2)10-16-14(7-6-12)15(17(19)20-16)11-21-9-8-18/h4,10,14-16,18H,3,5-9,11H2,1-2H3/b12-4+,13-10+/t14-,15-,16+/m0/s1
InChIKey MAKVSGSSYQDQDH-PPPQSOSOSA-N
Molecular Weight 310.452 g/mol
SMILES OCCSC[C@@]1(C(O[C@@]2(\C=C\(CC\C=C\(CC[C@@]12[H])C)C)[H])=O)[H]
SPLASH splash10-001i-9010000000-4f3e0eb4d36c8a2d7964
Source of Spectrum F-56-7774-15
Synonyms 3,7-Dimethyl-11-(hydroxyethylthiomethyl)-13-oxa-bicyclo[8.3.0]dodeca-2,6-dien-12-one
Wiley ID 858611