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t-Butyl 3-(1',3'-benzodioxol-5'-yl)-2-[(t-butoxycarbonyl)amino]-propanoate

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t-Butyl 3-(1',3'-benzodioxol-5'-yl)-2-[(t-butoxycarbonyl)amino]-propanoate
SpectraBase Compound ID 72XowmzZEu4
InChI InChI=1S/C19H27NO6/c1-18(2,3)25-16(21)13(20-17(22)26-19(4,5)6)9-12-7-8-14-15(10-12)24-11-23-14/h7-8,10,13H,9,11H2,1-6H3,(H,20,22)
InChIKey AQPFTQSDHZVHSL-UHFFFAOYSA-N
Mol Weight 365.43 g/mol
Molecular Formula C19H27NO6
Exact Mass 365.183838 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2mc5pm6hiCb
Name T-Butyl 3-(1',3'-benzodioxol-5'-yl)-2-[(T-butoxycarbonyl)amino]-propanoate
Comments Computed using HOSE algorithm
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Exact Mass 365.183837587 u
Formula C19H27NO6
InChI InChI=1S/C19H27NO6/c1-18(2,3)25-16(21)13(20-17(22)26-19(4,5)6)9-12-7-8-14-15(10-12)24-11-23-14/h7-8,10,13H,9,11H2,1-6H3,(H,20,22)
InChIKey AQPFTQSDHZVHSL-UHFFFAOYSA-N
Molecular Weight 365.426 g/mol
SMILES C(NC(C(OC(C)(C)C)=O)CC=1C=C2OCOC2=CC1)(OC(C)(C)C)=O