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N-Acetyltyrosine me
SpectraBase Compound ID BOkqdB9GqdY
InChI InChI=1S/C12H15NO4/c1-8(14)13-11(12(16)17-2)7-9-3-5-10(15)6-4-9/h3-6,11,15H,7H2,1-2H3,(H,13,14)
InChIKey KRMVXLWZDYZILN-UHFFFAOYSA-N
Mol Weight 237.25 g/mol
Molecular Formula C12H15NO4
Exact Mass 237.100108 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LL2PQehEyi3
Name N-Acetyltyrosine me
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 237.100107963 u
Formula C12H15NO4
InChI InChI=1S/C12H15NO4/c1-8(14)13-11(12(16)17-2)7-9-3-5-10(15)6-4-9/h3-6,11,15H,7H2,1-2H3,(H,13,14)
InChIKey KRMVXLWZDYZILN-UHFFFAOYSA-N
Molecular Weight 237.255 g/mol
SMILES C(NC(=O)C)(CC=1C=CC(=CC1)O)C(OC)=O