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3,4-Bis-tert-butoxycarbonyloxy-benzoic acid ethyl ester
SpectraBase Compound ID K8iD6UXmwp6
InChI InChI=1S/C19H26O8/c1-8-23-15(20)12-9-10-13(24-16(21)26-18(2,3)4)14(11-12)25-17(22)27-19(5,6)7/h9-11H,8H2,1-7H3
InChIKey CLSPZIVJQYLNPO-UHFFFAOYSA-N
Mol Weight 382.41 g/mol
Molecular Formula C19H26O8
Exact Mass 382.162768 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HvQFLNppzrJ
Name 3,4-bis-Tert-butoxycarbonyloxy-benzoic acid ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 382.162767789 u
Formula C19H26O8
InChI InChI=1S/C19H26O8/c1-8-23-15(20)12-9-10-13(24-16(21)26-18(2,3)4)14(11-12)25-17(22)27-19(5,6)7/h9-11H,8H2,1-7H3
InChIKey CLSPZIVJQYLNPO-UHFFFAOYSA-N
Molecular Weight 382.409 g/mol
SMILES C(OC(OC1=CC(C(OCC)=O)=CC=C1OC(OC(C)(C)C)=O)=O)(C)(C)C