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3-Phenyl-2,4(1H,3H)-quinazolinedione, tms derivative
SpectraBase Compound ID JTcft55xt58
InChI InChI=1S/C17H18N2O2Si/c1-22(2,3)21-17-18-15-12-8-7-11-14(15)16(20)19(17)13-9-5-4-6-10-13/h4-12H,1-3H3
InChIKey DHFNULDQSUEFGD-UHFFFAOYSA-N
Mol Weight 310.43 g/mol
Molecular Formula C17H18N2O2Si
Exact Mass 310.113754 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KYwqu5M2eno
Name 3-Phenyl-2,4(1H,3H)-quinazolinedione, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 310.113754361 u
Formula C17H18N2O2Si
InChI InChI=1S/C17H18N2O2Si/c1-22(2,3)21-17-18-15-12-8-7-11-14(15)16(20)19(17)13-9-5-4-6-10-13/h4-12H,1-3H3
InChIKey DHFNULDQSUEFGD-UHFFFAOYSA-N
Molecular Weight 310.428 g/mol
SMILES C1=2N=C(N(C(C2C=CC=C1)=O)C1=CC=CC=C1)O[Si](C)(C)C