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(1E,3R*,5S*,6S*,7S*)-6,8-Diacetoxy-3,5,7-trimethyl-1-phenyloct-1-ene
SpectraBase Compound ID 4WE9Ow1q15k
InChI InChI=1S/C21H30O4/c1-15(11-12-20-9-7-6-8-10-20)13-16(2)21(25-19(5)23)17(3)14-24-18(4)22/h6-12,15-17,21H,13-14H2,1-5H3/b12-11+/t15-,16-,17+,21-/m0/s1
InChIKey ALRXFQJQPHKLLY-DYLCRTRYSA-N
Mol Weight 346.47 g/mol
Molecular Formula C21H30O4
Exact Mass 346.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 58qJzBWERvs
Name (1E,3R*,5S*,6S*,7S*)-6,8-Diacetoxy-3,5,7-trimethyl-1-phenyloct-1-ene
Alternate Name(s) (1S,2S,4R,5E)-1-[(1R)-2-(acetyloxy)-1-methylethyl]-2,4-dimethyl-6-phenyl-5-hexenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O4
InChI InChI=1S/C21H30O4/c1-15(11-12-20-9-7-6-8-10-20)13-16(2)21(25-19(5)23)17(3)14-24-18(4)22/h6-12,15-17,21H,13-14H2,1-5H3/b12-11+/t15-,16-,17+,21-/m0/s1
InChIKey ALRXFQJQPHKLLY-DYLCRTRYSA-N
Molecular Weight 346.467 g/mol
SMILES [C@@](OC(=O)C)([C@](C[C@](\C=C\c1ccccc1)(C)[H])(C)[H])([C@@](COC(=O)C)(C)[H])[H]
SPLASH splash10-0006-6900000000-0045adca6fbdeb8b817e
Source of Spectrum KC-0-2660-28
Wiley ID 826144