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(3S,4S)-14-[(2S,3R,4R)-3-benzoxy-4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-tosyl-azetidin-2-yl]-3-methyl-tetradec-1-en-4-ol
SpectraBase Compound ID 44dQ76bJCdJ
InChI InChI=1S/C39H63NO5SSi/c1-9-32(3)37(41)24-20-15-13-11-10-12-14-19-23-35-38(44-29-33-21-17-16-18-22-33)36(30-45-47(7,8)39(4,5)6)40(35)46(42,43)34-27-25-31(2)26-28-34/h9,16-18,21-22,25-28,32,35-38,41H,1,10-15,19-20,23-24,29-30H2,2-8H3/t32-,35-,36+,37-,38+/m0/s1
InChIKey JOYLWUQIOVLMGN-BBMDXEPMSA-N
Mol Weight 686.1 g/mol
Molecular Formula C39H63NO5SSi
Exact Mass 685.419622 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Jm2LCk4hgM
Name (3S,4S)-14-[(2S,3R,4R)-3-benzoxy-4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-tosyl-azetidin-2-yl]-3-methyl-tetradec-1-en-4-ol
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Formula C39H63NO5SSi
InChI InChI=1S/C39H63NO5SSi/c1-9-32(3)37(41)24-20-15-13-11-10-12-14-19-23-35-38(44-29-33-21-17-16-18-22-33)36(30-45-47(7,8)39(4,5)6)40(35)46(42,43)34-27-25-31(2)26-28-34/h9,16-18,21-22,25-28,32,35-38,41H,1,10-15,19-20,23-24,29-30H2,2-8H3/t32-,35-,36+,37-,38+/m0/s1
InChIKey JOYLWUQIOVLMGN-BBMDXEPMSA-N
Molecular Weight 686.080 g/mol
SMILES O[C@]([C@](C=C)(C)[H])(CCCCCCCCCC[C@@]1(N(S(c2ccc(cc2)C)(=O)=O)[C@](CO[Si](C(C)(C)C)(C)C)([C@@]1(OCc1ccccc1)[H])[H])[H])[H]
SPLASH splash10-0006-9030000000-1892419cec18cb63570c
Source of Spectrum H1-47-344-18
Synonyms (3S,4S)-14-[(2S,3R,4R)-3-benzyloxy-4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(p-tolylsulfonyl)azetidin-2-yl]-3-methyl-tetradec-1-en-4-ol (3S,4S)-14-[(2S,3R,4R)-4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(4-methylphenyl)sulfonyl-3-phenylmethoxy-2-azetidinyl]-3-methyl-1-tetradecen-4-ol (3S,4S)-14-[(2S,3R,4R)-4-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(4-methylphenyl)sulfonyl-3-phenylmethoxy-azetidin-2-yl]-3-methyl-tetradec-1-en-4-ol
Wiley ID 816115