For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
N-Acetyl-3,5-Dibromo-tyrosine methyl ester
SpectraBase Compound ID BsVaKW8IAEx
InChI InChI=1S/C12H13Br2NO4/c1-6(16)15-10(12(18)19-2)5-7-3-8(13)11(17)9(14)4-7/h3-4,10,17H,5H2,1-2H3,(H,15,16)/t10-/m0/s1
InChIKey SFZBIDCBSHWGAA-JTQLQIEISA-N
Mol Weight 395.05 g/mol
Molecular Formula C12H13Br2NO4
Exact Mass 392.921134 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HRyOl7CL3by
Name N-Acetyl-3,5-Dibromo-tyrosine methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13Br2NO4
InChI InChI=1S/C12H13Br2NO4/c1-6(16)15-10(12(18)19-2)5-7-3-8(13)11(17)9(14)4-7/h3-4,10,17H,5H2,1-2H3,(H,15,16)/t10-/m0/s1
InChIKey SFZBIDCBSHWGAA-JTQLQIEISA-N
Molecular Weight 395.047 g/mol
SMILES N([C@@](Cc1cc(c(c(c1)Br)O)Br)(C(=O)OC)[H])C(=O)C
SPLASH splash10-000l-9016000000-2f44df598aaac7a3437f
Source of Spectrum KC-0-3119-6
Synonyms (S)N-Acetyl-3,5-Dibromo-tyrosine methyl ester Methyl 2-(acetylamino)-3-(3,5-dibromo-4-hydroxyphenyl)propanoate (2S)-2-acetamido-3-(3,5-dibromo-4-hydroxyphenyl)propanoic acid methyl ester Methyl (2S)-2-acetamido-3-(3,5-dibromo-4-hydroxyphenyl)propanoate Methyl (2S)-2-acetamido-3-(3,5-dibromo-4-hydroxy-phenyl)propanoate Methyl (2S)-2-acetamido-3-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]propanoate
Wiley ID 780327