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(E,E)-5-Hydroxy-3,7,11-trimethyldodeca-2,6,10-trien-1-yl acetate
SpectraBase Compound ID Ie3Fh5H3dv7
InChI InChI=1S/C17H28O3/c1-13(2)7-6-8-14(3)11-17(19)12-15(4)9-10-20-16(5)18/h7,9,11,17,19H,6,8,10,12H2,1-5H3/b14-11+,15-9+
InChIKey WYRDKICJTLYOPH-SROZLARBSA-N
Mol Weight 280.41 g/mol
Molecular Formula C17H28O3
Exact Mass 280.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CmMTtBXnhnv
Name (E,E)-5-Hydroxy-3,7,11-trimethyldodeca-2,6,10-trien-1-yl acetate
Classification Sesquiterpenoids
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 280.203844759 u
Formula C17H28O3
InChI InChI=1S/C17H28O3/c1-13(2)7-6-8-14(3)11-17(19)12-15(4)9-10-20-16(5)18/h7,9,11,17,19H,6,8,10,12H2,1-5H3/b14-11+,15-9+
InChIKey WYRDKICJTLYOPH-SROZLARBSA-N
Molecular Weight 280.408 g/mol
Number of Peaks 20
SMILES OC(\C=C\(CCC=C(C)C)C)C\C(=C\COC(C)=O)C
SPLASH splash10-0a5c-5900000000-e07bb7d56296d47ce374
Source of Spectrum FF-12-76-90 (DOI: 10.1002_(SICI)1099-1026(199703)12_2_71)
Synonyms (2E,6E)-5-hydroxy-3,7,11-trimethyldodeca-2,6,10-trien-1-yl acetate Acetic acid [(2E,6E)-5-hydroxy-3,7,11-trimethyldodeca-2,6,10-trienyl] ester [(2E,6E)-5-hydroxy-3,7,11-trimethyldodeca-2,6,10-trienyl] acetate [(2E,6E)-5-hydroxy-3,7,11-trimethyl-dodeca-2,6,10-trienyl] acetate [(2E,6E)-3,7,11-trimethyl-5-oxidanyl-dodeca-2,6,10-trienyl] ethanoate
Wiley ID 1775127