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3,5-Dinitrobenzyl alcohol, benzyldimethylsilyl ether
SpectraBase Compound ID A0aExCjt4zh
InChI InChI=1S/C16H18N2O5Si/c1-24(2,12-13-6-4-3-5-7-13)23-11-14-8-15(17(19)20)10-16(9-14)18(21)22/h3-10H,11-12H2,1-2H3
InChIKey HBTOAUWRLJJLSL-UHFFFAOYSA-N
Mol Weight 346.41 g/mol
Molecular Formula C16H18N2O5Si
Exact Mass 346.098498 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JD75k3ACX3m
Name 3,5-Dinitrobenzyl alcohol, benzyldimethylsilyl ether
Comments Computed using HOSE algorithm
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Exact Mass 346.098498218 u
Formula C16H18N2O5Si
InChI InChI=1S/C16H18N2O5Si/c1-24(2,12-13-6-4-3-5-7-13)23-11-14-8-15(17(19)20)10-16(9-14)18(21)22/h3-10H,11-12H2,1-2H3
InChIKey HBTOAUWRLJJLSL-UHFFFAOYSA-N
Molecular Weight 346.414 g/mol
SMILES C1=C(C=C(C=C1CO[Si](CC1=CC=CC=C1)(C)C)N(=O)=O)N(=O)=O