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L-Tryptophan, N,N'-dimethoxycarbonyl-, methyl ester

View entire compound with spectra: 1 NMR

L-Tryptophan, N,N'-dimethoxycarbonyl-, methyl ester
SpectraBase Compound ID JIkBTXTQ6Fi
InChI InChI=1S/C16H18N2O6/c1-22-14(19)12(17-15(20)23-2)8-10-9-18(16(21)24-3)13-7-5-4-6-11(10)13/h4-7,9,12H,8H2,1-3H3,(H,17,20)
InChIKey UBGHTVBRYQYNCZ-UHFFFAOYSA-N
Mol Weight 334.33 g/mol
Molecular Formula C16H18N2O6
Exact Mass 334.116486 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LET7XtKdnFD
Name L-Tryptophan, N,N'-dimethoxycarbonyl-, methyl ester
Comments Computed using HOSE algorithm
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Exact Mass 334.116486302 u
Formula C16H18N2O6
InChI InChI=1S/C16H18N2O6/c1-22-14(19)12(17-15(20)23-2)8-10-9-18(16(21)24-3)13-7-5-4-6-11(10)13/h4-7,9,12H,8H2,1-3H3,(H,17,20)
InChIKey UBGHTVBRYQYNCZ-UHFFFAOYSA-N
Molecular Weight 334.328 g/mol
SMILES C1=CC=CC2=C1C(=CN2C(OC)=O)CC(NC(OC)=O)C(OC)=O