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(S)-2-(3-(Trimethylsilyl)prop-2-yn-1-yl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione
SpectraBase Compound ID 3wrEGq4IGlz
InChI InChI=1S/C12H18N2O2Si/c1-17(2,3)9-5-8-14-11(15)10-6-4-7-13(10)12(14)16/h10H,4,6-8H2,1-3H3/t10-/m0/s1
InChIKey KXYSRRPNUWLPIZ-JTQLQIEISA-N
Mol Weight 250.37 g/mol
Molecular Formula C12H18N2O2Si
Exact Mass 250.113754 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 61i7DhhDkPd
Name (S)-2-(3-(Trimethylsilyl)prop-2-yn-1-yl)tetrahydro-1H-pyrrolo[1,2-c]imidazole-1,3(2H)-dione
Appearance Colorless viscous oil
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Formula C12H18N2O2Si
InChI InChI=1S/C12H18N2O2Si/c1-17(2,3)9-5-8-14-11(15)10-6-4-7-13(10)12(14)16/h10H,4,6-8H2,1-3H3/t10-/m0/s1
InChIKey KXYSRRPNUWLPIZ-JTQLQIEISA-N
Instrument Name Micromass GCT
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202000574
Molecular Weight 250.373 g/mol
Optical Rotation [a]D = -96.5 (c = 1.0, acetone)
Reported Formula C12H18N2O2Si
SMILES C1(N2[C@](C(N1CC#C[Si](C)(C)C)=O)(CCC2)[H])=O
SPLASH splash10-01p9-2290000000-e1bad04c27f1e027ea61
Source of Spectrum ASC-362-4402-15
Thin-Layer Chromatography Rf = 0.57 (silica gel, EtOAc/hexanes, 50:50)
Wiley ID 1855559