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2-[(2E,6E,10E,14Z)-5,16-Dihydroxy-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl]-6-methyl-1,4-benzenediol
SpectraBase Compound ID 4PObw5y9fDr
InChI InChI=1S/C27H40O4/c1-19(9-7-11-22(4)18-28)8-6-10-20(2)14-25(29)15-21(3)12-13-24-17-26(30)16-23(5)27(24)31/h8,11-12,14,16-17,25,28-31H,6-7,9-10,13,15,18H2,1-5H3/b19-8+,20-14+,21-12+,22-11-
InChIKey JOVUEIUZJMDZAL-XTMKDLMASA-N
Mol Weight 428.6 g/mol
Molecular Formula C27H40O4
Exact Mass 428.29266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FRNhyWDIKtG
Name 2-[(2E,6E,10E,14Z)-5,16-Dihydroxy-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl]-6-methyl-1,4-benzenediol
Alternate Name(s) 1,4-Benzenediol, 2-(5,16-dihydroxy-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenyl)-6-methyl-, (E,Z,E,E)- 2-[(2E,6E,10E,14Z)-5,16-dihydroxy-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl]-6-methylbenzene-1,4-diol 2-[(2E,6E,10E,14Z)-5,16-dihydroxy-3,7,11,15-tetramethyl-hexadeca-2,6,10,14-tetraenyl]-6-methyl-benzene-1,4-diol 2-Methyl-6-[(2E,6E,10E,14Z)-3,7,11,15-tetramethyl-5,16-bis(oxidanyl)hexadeca-2,6,10,14-tetraenyl]benzene-1,4-diol
CAS Registry Number 115788-02-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H40O4
InChI InChI=1S/C27H40O4/c1-19(9-7-11-22(4)18-28)8-6-10-20(2)14-25(29)15-21(3)12-13-24-17-26(30)16-23(5)27(24)31/h8,11-12,14,16-17,25,28-31H,6-7,9-10,13,15,18H2,1-5H3/b19-8+,20-14+,21-12+,22-11-
InChIKey JOVUEIUZJMDZAL-XTMKDLMASA-N
Molecular Weight 428.613 g/mol
SMILES Oc1cc(C\C=C\(CC(\C=C\(CC\C=C\(CC\C=C/(CO)C)C)C)O)C)c(c(c1)C)O
SPLASH splash10-004u-7900000000-98bf25b13f1fc6cce50f
Source of Spectrum NP-15-25-0
Wiley ID 1112167