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2-Methyl-6-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]benzene-1,4-diol
SpectraBase Compound ID m00IFpt2q6
InChI InChI=1S/C27H40O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-15-23(5)16-17-25-19-26(28)18-24(6)27(25)29/h10,12,14,16,18-19,28-29H,7-9,11,13,15,17H2,1-6H3/b21-12+,22-14+,23-16+
InChIKey DOWCCBNJUZOLRJ-MLAGYPMBSA-N
Mol Weight 396.6 g/mol
Molecular Formula C27H40O2
Exact Mass 396.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BA1DYqWZa6q
Name 2-Methyl-6-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]benzene-1,4-diol
Alternate Name(s) 2-Methyl-6-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]hydroquinone
CAS Registry Number 57576-81-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H40O2
InChI InChI=1S/C27H40O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-15-23(5)16-17-25-19-26(28)18-24(6)27(25)29/h10,12,14,16,18-19,28-29H,7-9,11,13,15,17H2,1-6H3/b21-12+,22-14+,23-16+
InChIKey DOWCCBNJUZOLRJ-MLAGYPMBSA-N
Molecular Weight 396.615 g/mol
SMILES Oc1cc(c(c(c1)C)O)C\C=C\(CC\C=C\(CC\C=C\(CCC=C(C)C)C)C)C
SPLASH splash10-015i-9101000000-d3166289867a31ba989f
Source of Spectrum KC-1990-2270-6
Wiley ID 1367749