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(1E,3E)-2-[2'-(2",6",6"-TRIMETHYLCYCLOHEX-2"-ENYL) ETHYL] BUTA-1,3-DIENE-1,4-DIYLDIACETATE

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(1E,3E)-2-[2'-(2",6",6"-TRIMETHYLCYCLOHEX-2"-ENYL) ETHYL] BUTA-1,3-DIENE-1,4-DIYLDIACETATE
SpectraBase Compound ID 8igBVbyzJ0E
InChI InChI=1S/C19H28O4/c1-14-7-6-11-19(4,5)18(14)9-8-17(13-23-16(3)21)10-12-22-15(2)20/h7,10,12-13,18H,6,8-9,11H2,1-5H3/b12-10+,17-13+
InChIKey XTJQNWBGKWKIKL-QIYIKKHUSA-N
Mol Weight 320.43 g/mol
Molecular Formula C19H28O4
Exact Mass 320.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2jlxdJwHGS
Name 1,3-Butadiene-1,4-diol, 2-[2-(2,6,6-trimethyl-2-cyclohexen-1-yl)ethyl]-, diacetate, (E,E)-
CAS Registry Number 79689-22-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O4
InChI InChI=1S/C19H28O4/c1-14-7-6-11-19(4,5)18(14)9-8-17(13-23-16(3)21)10-12-22-15(2)20/h7,10,12-13,18H,6,8-9,11H2,1-5H3/b12-10+,17-13+
InChIKey XTJQNWBGKWKIKL-QIYIKKHUSA-N
Molecular Weight 320.429 g/mol
SMILES C1(C(=CCCC1(C)C)C)CC\C(=C/OC(=O)C)\C=C\OC(=O)C
SPLASH splash10-0076-5940000000-3e06af391ec8e1e3476e
Source of Spectrum B-34-1778-0
Synonyms (1E,3E)-2-[2'-(2'',6'',6''-trimethylcyclohex-2''-enyl)ethyl]buta-1,3-diene-1,4-diyl diacetate (1E,3E)-2-[2'-(2'',6'',6''-Trimethylcyclohex-2''-enyl)ethyl]buta-1,3-diene-1,4-diyl diacetate (1E,3E)-4-(acetyloxy)-2-[2-(2,6,6-trimethyl-2-cyclohexen-1-yl)ethyl]-1,3-butadienyl acetate Acetic acid[(1E,3E)-4-acetoxy-3-[2-(2,6,6-trimethylcyclohex-2-en-1-yl)ethyl]buta-1,3-dienyl]ester Acetic acid[(E,3E)-3-(acetyloxymethylidene)-5-(2,6,6-trimethyl-1-cyclohex-2-enyl)pent-1-enyl]ester [(E,3E)-3-(acetoxymethylene)-5-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-1-enyl]acetate [(E,3E)-3-(acetyloxymethylidene)-5-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-1-enyl]acetate [(E,3E)-3-(acetyloxymethylidene)-5-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-1-enyl]ethanoate Acetic acid [(E,3E)-3-(acetyloxymethylidene)-5-(2,6,6-trimethyl-1-cyclohex-2-enyl)pent-1-enyl] ester [(E,3E)-3-(acetyloxymethylidene)-5-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-1-enyl] acetate [(E,3E)-3-(acetoxymethylene)-5-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-1-enyl] acetate [(E,3E)-3-(acetyloxymethylidene)-5-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-1-enyl] ethanoate
Wiley ID 1320267