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2-[(1'E)-3'-Methoxy-3',7'-dimethylocta-1',6'-dienyl]benzene-1,4-diol
SpectraBase Compound ID 8WYJnVMZDwH
InChI InChI=1S/C17H24O3/c1-13(2)6-5-10-17(3,20-4)11-9-14-12-15(18)7-8-16(14)19/h6-9,11-12,18-19H,5,10H2,1-4H3/b11-9+
InChIKey QUPBFABSSBYELF-PKNBQFBNSA-N
Mol Weight 276.38 g/mol
Molecular Formula C17H24O3
Exact Mass 276.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8YlcxNIiKss
Name 2-[(1'E)-3'-Methoxy-3',7'-dimethylocta-1',6'-dienyl]benzene-1,4-diol
Appearance Orange oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O3
InChI InChI=1S/C17H24O3/c1-13(2)6-5-10-17(3,20-4)11-9-14-12-15(18)7-8-16(14)19/h6-9,11-12,18-19H,5,10H2,1-4H3/b11-9+
InChIKey QUPBFABSSBYELF-PKNBQFBNSA-N
Instrument Name Finnigan Voyager GC 8000top
Ionization Type EI
Literature Reference DOI 10.1021/np020176+
Optical Rotation [a]D27 = +13.2 (c = 0.20, CHCl3)
SMILES Oc1ccc(c(c1)\C=C\C(CCC=C(C)C)(OC)C)O
SPLASH splash10-03di-0940000000-65d7afff2a21062d51c9
Source of Spectrum G4-65-1330-3
Wiley ID 1883871