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(1R*,9R*,10S*,Z)-9-Acetoxy-11-[2-(tert-butyldimethylsilyloxy)ethyl]-1-methoxy-11-azabicyclo[8.2.0]dodec-5-ene-3,7-diyne-12-one
SpectraBase Compound ID BG37sIvXVlE
InChI InChI=1S/C22H31NO5Si/c1-17(24)28-18-13-11-9-8-10-12-14-22(26-5)19(18)23(20(22)25)15-16-27-29(6,7)21(2,3)4/h8-9,18-19H,14-16H2,1-7H3/b9-8-/t18-,19+,22-/m1/s1
InChIKey PXICIMYKIHUFIV-RYQWKWSKSA-N
Mol Weight 417.58 g/mol
Molecular Formula C22H31NO5Si
Exact Mass 417.19715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID nUgoJBG90u
Name (1R*,9R*,10S*,Z)-9-Acetoxy-11-[2-(tert-butyldimethylsilyloxy)ethyl]-1-methoxy-11-azabicyclo[8.2.0]dodec-5-ene-3,7-diyne-12-one
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Formula C22H31NO5Si
InChI InChI=1S/C22H31NO5Si/c1-17(24)28-18-13-11-9-8-10-12-14-22(26-5)19(18)23(20(22)25)15-16-27-29(6,7)21(2,3)4/h8-9,18-19H,14-16H2,1-7H3/b9-8-/t18-,19+,22-/m1/s1
InChIKey PXICIMYKIHUFIV-RYQWKWSKSA-N
Molecular Weight 417.577 g/mol
SMILES [C@@]12(C(=O)N([C@]2([C@@](C#C\C=C/C#CC1)(OC(=O)C)[H])[H])CCO[Si](C(C)(C)C)(C)C)OC
SPLASH splash10-006x-7900000000-b2763d2dbba83efa81f0
Source of Spectrum U1-2002-3753-24
Synonyms (1R,9R,10S)-11-(2-{[tert-butyl(dimethyl)silyl]oxy}ethyl)-1-methoxy-12-oxo-11-azabicyclo[8.2.0]dodec-5-ene-3,7-diyn-9-yl acetate Acetic acid [(1S,2R,5Z,10R)-12-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-10-methoxy-11-oxo-12-azabicyclo[8.2.0]dodec-5-en-3,7-diyn-2-yl] ester [(1S,2R,5Z,10R)-12-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-10-methoxy-11-oxo-12-azabicyclo[8.2.0]dodec-5-en-3,7-diyn-2-yl] acetate [(1S,2R,5Z,10R)-12-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-10-methoxy-11-oxidanylidene-12-azabicyclo[8.2.0]dodec-5-en-3,7-diyn-2-yl] ethanoate
Wiley ID 1523483