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tyrosine, N-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]-
SpectraBase Compound ID 5elf1mDvcj1
InChI InChI=1S/C16H17NO7/c1-16(2)23-14(21)11(15(22)24-16)8-17-12(13(19)20)7-9-3-5-10(18)6-4-9/h3-6,8,12,17-18H,7H2,1-2H3,(H,19,20)
InChIKey IOJTZNMWKQIQNG-UHFFFAOYSA-N
Mol Weight 335.31 g/mol
Molecular Formula C16H17NO7
Exact Mass 335.100502 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DJXpnqGrF7V
Name Tyrosine, N-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.100501884 u
Formula C16H17NO7
InChI InChI=1S/C16H17NO7/c1-16(2)23-14(21)11(15(22)24-16)8-17-12(13(19)20)7-9-3-5-10(18)6-4-9/h3-6,8,12,17-18H,7H2,1-2H3,(H,19,20)
InChIKey IOJTZNMWKQIQNG-UHFFFAOYSA-N
Molecular Weight 335.312 g/mol
SMILES N(C=C1C(OC(OC1=O)(C)C)=O)C(CC=1C=CC(=CC1)O)C(=O)O