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1-{(Z)-5alpha-([(tert-Butyl)dimethylsilyll]oxy}-2alpha-{(E,E)-4-methyl-6-{[(RS)-tetrahydro-2H-pyran-2-oxy}hexa-1,4-dienyl}-2-methylcyclopentylidene}heptan-2-one
SpectraBase Compound ID 5HSEzCzNzax
InChI InChI=1S/C31H54O4Si/c1-9-10-11-16-26(32)24-27-28(35-36(7,8)30(3,4)5)18-21-31(27,6)20-14-15-25(2)19-23-34-29-17-12-13-22-33-29/h14,19-20,24,28-29H,9-13,15-18,21-23H2,1-8H3/b20-14+,25-19+,27-24+/t28-,29?,31+/m1/s1
InChIKey LXOVYYINKBSBSO-RNKKMREISA-N
Mol Weight 518.9 g/mol
Molecular Formula C31H54O4Si
Exact Mass 518.379137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID taMaCh5Q5q
Name 1-{(Z)-5alpha-([(tert-Butyl)dimethylsilyll]oxy}-2alpha-{(E,E)-4-methyl-6-{[(RS)-tetrahydro-2H-pyran-2-oxy}hexa-1,4-dienyl}-2-methylcyclopentylidene}heptan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H54O4Si
InChI InChI=1S/C31H54O4Si/c1-9-10-11-16-26(32)24-27-28(35-36(7,8)30(3,4)5)18-21-31(27,6)20-14-15-25(2)19-23-34-29-17-12-13-22-33-29/h14,19-20,24,28-29H,9-13,15-18,21-23H2,1-8H3/b20-14+,25-19+,27-24+/t28-,29?,31+/m1/s1
InChIKey LXOVYYINKBSBSO-RNKKMREISA-N
Literature Reference DOI 10.1002/hlca.19910740308
Molecular Weight 518.854 g/mol
SMILES C(OC1OCCCC1)\C=C/(C)C\C=C\[C@@]1(\C([C@@](CC1)(O[Si](C)(C(C)(C)C)C)[H])=C\C(CCCCC)=O)C
SPLASH splash10-004r-5393000000-bbfce41724f802a01e08
Source of Spectrum H-74-528-3g
Synonyms (Z)-1-((2R,5R)-5-((tert-butyldimethylsilyl)oxy)-2-methyl-2-((1E,4E)-4-methyl-6-((tetrahydro-2H-pyran-2-yl)oxy)hexa-1,4-dien-1-yl)cyclopentylidene)heptan-2-one
Wiley ID 1789210