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(1R,7aS)-1-Hydroxy-2-(3-(trimethylsilyl)prop-2-yn-1-yl)tetrahydro-1H-pyrrolo[1,2-c]imidazol-3(2H)-one
SpectraBase Compound ID CeOxsHyFthI
InChI InChI=1S/C12H20N2O2Si/c1-17(2,3)9-5-8-14-11(15)10-6-4-7-13(10)12(14)16/h10-11,15H,4,6-8H2,1-3H3/t10-,11+/m0/s1
InChIKey JOYLFRBAJYXOCC-WDEREUQCSA-N
Mol Weight 252.39 g/mol
Molecular Formula C12H20N2O2Si
Exact Mass 252.129404 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3m5SGBfzsG
Name (1R,7aS)-1-Hydroxy-2-(3-(trimethylsilyl)prop-2-yn-1-yl)tetrahydro-1H-pyrrolo[1,2-c]imidazol-3(2H)-one
Appearance Colorless solid
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Formula C12H20N2O2Si
InChI InChI=1S/C12H20N2O2Si/c1-17(2,3)9-5-8-14-11(15)10-6-4-7-13(10)12(14)16/h10-11,15H,4,6-8H2,1-3H3/t10-,11+/m0/s1
InChIKey JOYLFRBAJYXOCC-WDEREUQCSA-N
Instrument Name Micromass GCT
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202000574
Molecular Weight 252.389 g/mol
Optical Rotation [a]D = -53.3 (c = 1.01, acetone)
Reported Formula C12H20N2O2Si
SMILES O[C@@]1([C@]2(N(C(N1CC#C[Si](C)(C)C)=O)CCC2)[H])[H]
SPLASH splash10-00ei-3590000000-c266cde01fbf1337920f
Source of Spectrum ASC-362-4404-17
Thin-Layer Chromatography Rf = 0.23 (silica gel, EtOAc/hexanes, 50:50)
Wiley ID 1855561