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(4S,5R,6R,7R,8R)-4-tert-Butyldimethylsilyloxy-5-acetamido-6,7:8,9-di-O-isopropylidene-1-nonyne
SpectraBase Compound ID EY8XXXBPtKy
InChI InChI=1S/C23H41NO6Si/c1-12-13-16(30-31(10,11)21(3,4)5)18(24-15(2)25)20-19(28-23(8,9)29-20)17-14-26-22(6,7)27-17/h1,16-20H,13-14H2,2-11H3,(H,24,25)/t16-,17+,18-,19+,20+/m0/s1
InChIKey QGRIHYUSEHHCQJ-PXTPFGJHSA-N
Mol Weight 455.7 g/mol
Molecular Formula C23H41NO6Si
Exact Mass 455.270315 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C3ilurs2gsG
Name (4S,5R,6R,7R,8R)-4-tert-Butyldimethylsilyloxy-5-acetamido-6,7:8,9-di-O-isopropylidene-1-nonyne
Comments Less than 3 mono-isotopic peaks
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Formula C23H41NO6Si
InChI InChI=1S/C23H41NO6Si/c1-12-13-16(30-31(10,11)21(3,4)5)18(24-15(2)25)20-19(28-23(8,9)29-20)17-14-26-22(6,7)27-17/h1,16-20H,13-14H2,2-11H3,(H,24,25)/t16-,17+,18-,19+,20+/m0/s1
InChIKey QGRIHYUSEHHCQJ-PXTPFGJHSA-N
Molecular Weight 455.667 g/mol
SMILES N([C@]([C@@]1([C@@]([C@@]2(OC(C)(C)OC2)[H])(OC(O1)(C)C)[H])[H])([C@@](O[Si](C(C)(C)C)(C)C)(CC#C)[H])[H])C(=O)C
SPLASH splash10-0006-0009500000-063dfd7ad18ff7a530c5
Source of Spectrum J-67-6762-21
Wiley ID 1570925