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(2E,2'S,3'R,5'Z,8'S,9'R)-4-{(8'-Benzyloxy-9'-benzyloxymethyl-2'-vinyl-2',3',4',7',8',9'-hexahydrooxonin-3'-yl)oxy}-5-(tert-butyldimethylsilyloxy)-2-pentenal
SpectraBase Compound ID IeH7KkTqj7f
InChI InChI=1S/C36H50O6Si/c1-7-32-34(41-31(21-16-24-37)27-40-43(5,6)36(2,3)4)23-15-14-22-33(39-26-30-19-12-9-13-20-30)35(42-32)28-38-25-29-17-10-8-11-18-29/h7-21,24,31-35H,1,22-23,25-28H2,2-6H3/b15-14-,21-16+/t31?,32-,33-,34+,35+/m0/s1
InChIKey HJMBXUPQYVRPIB-VNYVCDEHSA-N
Mol Weight 606.9 g/mol
Molecular Formula C36H50O6Si
Exact Mass 606.337666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HU6oJ19RuF6
Name (2E,2'S,3'R,5'Z,8'S,9'R)-4-{(8'-Benzyloxy-9'-benzyloxymethyl-2'-vinyl-2',3',4',7',8',9'-hexahydrooxonin-3'-yl)oxy}-5-(tert-butyldimethylsilyloxy)-2-pentenal
Alternate Name(s) (2E)-4-({(2S,3R,8S,9R)-8-(benzyloxy)-9-[(benzyloxy)methyl]-2-vinyl-2,3,4,7,8,9-hexahydro-3-oxoninyl}oxy)-5-{[tert-butyl(dimethyl)silyl]oxy}-2-pentenal
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H50O6Si
InChI InChI=1S/C36H50O6Si/c1-7-32-34(41-31(21-16-24-37)27-40-43(5,6)36(2,3)4)23-15-14-22-33(39-26-30-19-12-9-13-20-30)35(42-32)28-38-25-29-17-10-8-11-18-29/h7-21,24,31-35H,1,22-23,25-28H2,2-6H3/b15-14-,21-16+/t31?,32-,33-,34+,35+/m0/s1
InChIKey HJMBXUPQYVRPIB-VNYVCDEHSA-N
Molecular Weight 606.875 g/mol
SMILES [C@]1(O[C@]([C@@](C\C=C/C[C@@]1(OCc1ccccc1)[H])(OC(CO[Si](C(C)(C)C)(C)C)\C=C\C=O)[H])(C=C)[H])(COCc1ccccc1)[H]
SPLASH splash10-03di-0090001000-d64b02763bdff565d14b
Source of Spectrum KC-61-7407-44
Wiley ID 1629986