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3-(4-oxo-1,2,3-Benzotriazin-3(4H)-yl)propanoic acid, tms derivative
SpectraBase Compound ID F1Ih1NcvyCl
InChI InChI=1S/C13H17N3O3Si/c1-20(2,3)19-12(17)8-9-16-13(18)10-6-4-5-7-11(10)14-15-16/h4-7H,8-9H2,1-3H3
InChIKey KSNYQSIRSVMPSK-UHFFFAOYSA-N
Mol Weight 291.38 g/mol
Molecular Formula C13H17N3O3Si
Exact Mass 291.103918 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 75e00va171w
Name 3-(4-oxo-1,2,3-Benzotriazin-3(4H)-yl)propanoic acid, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 291.103917951 u
Formula C13H17N3O3Si
InChI InChI=1S/C13H17N3O3Si/c1-20(2,3)19-12(17)8-9-16-13(18)10-6-4-5-7-11(10)14-15-16/h4-7H,8-9H2,1-3H3
InChIKey KSNYQSIRSVMPSK-UHFFFAOYSA-N
SMILES C(CCN1N=NC2=CC=CC=C2C1=O)(=O)O[Si](C)(C)C