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(2S,3R,4R)-2-tert-Butyldimethylsilyloxymethyl-3-benzyloxy-4-(11'-hydroxyundecyl)-N-p-tolylsulfonylazetidine
SpectraBase Compound ID J5e0NJMbCTQ
InChI InChI=1S/C35H57NO5SSi/c1-29-22-24-31(25-23-29)42(38,39)36-32(21-17-12-10-8-7-9-11-13-18-26-37)34(40-27-30-19-15-14-16-20-30)33(36)28-41-43(5,6)35(2,3)4/h14-16,19-20,22-25,32-34,37H,7-13,17-18,21,26-28H2,1-6H3/t32-,33+,34+/m0/s1
InChIKey OZAIBGQWLIVQKT-LBFZIJHGSA-N
Mol Weight 632.0 g/mol
Molecular Formula C35H57NO5SSi
Exact Mass 631.372672 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GefdR0f6RJv
Name (2S,3R,4R)-2-tert-Butyldimethylsilyloxymethyl-3-benzyloxy-4-(11'-hydroxyundecyl)-N-p-tolylsulfonylazetidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H57NO5SSi
InChI InChI=1S/C35H57NO5SSi/c1-29-22-24-31(25-23-29)42(38,39)36-32(21-17-12-10-8-7-9-11-13-18-26-37)34(40-27-30-19-15-14-16-20-30)33(36)28-41-43(5,6)35(2,3)4/h14-16,19-20,22-25,32-34,37H,7-13,17-18,21,26-28H2,1-6H3/t32-,33+,34+/m0/s1
InChIKey OZAIBGQWLIVQKT-LBFZIJHGSA-N
Molecular Weight 631.988 g/mol
SMILES OCCCCCCCCCCC[C@@]1(N(S(c2ccc(cc2)C)(=O)=O)[C@](CO[Si](C(C)(C)C)(C)C)([C@@]1(OCc1ccccc1)[H])[H])[H]
SPLASH splash10-0006-9020000000-c17f7a0b7eaaf2a5d8ab
Source of Spectrum H1-47-343-16
Synonyms (2R,3R,4S)-2-tert-Butyldimethylsilyloxy-3-benzyloxy-4-(11'-hydroxyundecyl)-N-p-tolylsulfonylazetidine 11-{(2S,3R,4R)-3-(benzyloxy)-4-({[tert-butyl(dimethyl)silyl]oxy}methyl)-1-[(4-methylphenyl)sulfonyl]azetidinyl}-1-undecanol
Wiley ID 816116