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(2E,6E,9S,11S)-2,6-Dimethyl-9,11-di(prop-1-en-2-yl)cyclododeca-2,6-dienone
SpectraBase Compound ID IFIJZ0kFeGx
InChI InChI=1S/C20H30O/c1-14(2)18-11-10-16(5)8-7-9-17(6)20(21)13-19(12-18)15(3)4/h9-10,18-19H,1,3,7-8,11-13H2,2,4-6H3/b16-10+,17-9+/t18-,19-/m0/s1
InChIKey HSUFHLQPGUZIEO-FLFOOUFRSA-N
Mol Weight 286.46 g/mol
Molecular Formula C20H30O
Exact Mass 286.229666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1N6tUp1jISS
Name (2E,6E,9S,11S)-2,6-Dimethyl-9,11-di(prop-1-en-2-yl)cyclododeca-2,6-dienone
Alternate Name(s) (2E,6E,9S,11S)-2,6-dimethyl-9,11-di(prop-1-en-2-yl)cyclododeca-2,6-dien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O
InChI InChI=1S/C20H30O/c1-14(2)18-11-10-16(5)8-7-9-17(6)20(21)13-19(12-18)15(3)4/h9-10,18-19H,1,3,7-8,11-13H2,2,4-6H3/b16-10+,17-9+/t18-,19-/m0/s1
InChIKey HSUFHLQPGUZIEO-FLFOOUFRSA-N
Literature Reference DOI 10.1002/anie.201205143
Molecular Weight 286.459 g/mol
SMILES [C@@]1(C[C@](C(=C)C)(CC(\C(=C\CC\C(C)=C\C1)C)=O)[H])(C(=C)C)[H]
SPLASH splash10-008c-9420000000-e4f4035bd2b015e4960f
Source of Spectrum ACI-51-SM17-16
Wiley ID 1780693