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(3S,6R,7S,8S)-3,7-Bis(tert-butyldimethylsilyloxy)-4,4,6,8-tetramethyl-5-oxotetradeca-12-ynoic acid 1-[(1S,1E)-1-methyl-2-(2-methyl-1,3-thiazol-4-yl)vinyl]pent-3-ynyl ester
SpectraBase Compound ID 6t0qc2RRxl4
InChI InChI=1S/C42H71NO5SSi2/c1-19-21-23-24-25-30(3)38(48-51(17,18)41(10,11)12)32(5)39(45)42(13,14)36(47-50(15,16)40(7,8)9)28-37(44)46-35(26-22-20-2)31(4)27-34-29-49-33(6)43-34/h27,29-30,32,35-36,38H,23-26,28H2,1-18H3/b31-27+/t30-,32+,35?,36-,38-/m0/s1
InChIKey RPOUGHZOLRRQIE-LRZRNMAHSA-N
Mol Weight 758.3 g/mol
Molecular Formula C42H71NO5SSi2
Exact Mass 757.459149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7hWVa8jDUE5
Name (3S,6R,7S,8S)-3,7-Bis(tert-butyldimethylsilyloxy)-4,4,6,8-tetramethyl-5-oxotetradeca-12-ynoic acid 1-[(1S,1E)-1-methyl-2-(2-methyl-1,3-thiazol-4-yl)vinyl]pent-3-ynyl ester
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Formula C42H71NO5SSi2
InChI InChI=1S/C42H71NO5SSi2/c1-19-21-23-24-25-30(3)38(48-51(17,18)41(10,11)12)32(5)39(45)42(13,14)36(47-50(15,16)40(7,8)9)28-37(44)46-35(26-22-20-2)31(4)27-34-29-49-33(6)43-34/h27,29-30,32,35-36,38H,23-26,28H2,1-18H3/b31-27+/t30-,32+,35?,36-,38-/m0/s1
InChIKey RPOUGHZOLRRQIE-LRZRNMAHSA-N
Molecular Weight 758.262 g/mol
SMILES C(C([C@](CC(OC(\C(=C\c1nc(C)sc1)C)CC#CC)=O)(O[Si](C(C)(C)C)(C)C)[H])(C)C)([C@@]([C@@](O[Si](C(C)(C)C)(C)C)([C@](CCCC#CC)(C)[H])[H])(C)[H])=O
SPLASH splash10-0udi-1090000000-e1d548260b9e0025768e
Source of Spectrum QE-7-5313-113
Synonyms 1-[(E)-1-methyl-2-(2-methyl-1,3-thiazol-4-yl)ethenyl]-3-pentynyl (3S,6R,7S,8S)-3,7-bis{[tert-butyl(dimethyl)silyl]oxy}-4,4,6,8-tetramethyl-5-oxo-12-tetradecynoate
Wiley ID 846236