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Iminodiacetic acid, N-[[5-fluorenyloxy]carbonyl]-
SpectraBase Compound ID 2JpnHqg1g0B
InChI InChI=1S/C19H17NO6/c21-17(22)9-20(10-18(23)24)19(25)26-11-16-14-7-3-1-5-12(14)13-6-2-4-8-15(13)16/h1-8,16H,9-11H2,(H,21,22)(H,23,24)
InChIKey LNHILYINDTUUMZ-UHFFFAOYSA-N
Mol Weight 355.35 g/mol
Molecular Formula C19H17NO6
Exact Mass 355.105587 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7BxNZi2gsNa
Name Iminodiacetic acid, N-[[5-fluorenyloxy]carbonyl]-
Comments Computed using HOSE algorithm
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Exact Mass 355.105587265 u
Formula C19H17NO6
InChI InChI=1S/C19H17NO6/c21-17(22)9-20(10-18(23)24)19(25)26-11-16-14-7-3-1-5-12(14)13-6-2-4-8-15(13)16/h1-8,16H,9-11H2,(H,21,22)(H,23,24)
InChIKey LNHILYINDTUUMZ-UHFFFAOYSA-N
Molecular Weight 355.346 g/mol
SMILES C12=C(C=CC=C2)C2=CC=CC=C2C1COC(=O)N(CC(O)=O)CC(O)=O