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N-[2-(3,4-Dimethoxyphenyl)ethyl]-N-methanesulfonylalanine
SpectraBase Compound ID AWFJBIDG37g
InChI InChI=1S/C14H21NO6S/c1-10(14(16)17)15(22(4,18)19)8-7-11-5-6-12(20-2)13(9-11)21-3/h5-6,9-10H,7-8H2,1-4H3,(H,16,17)
InChIKey UGBOGHFNKVEHJG-UHFFFAOYSA-N
Mol Weight 331.38 g/mol
Molecular Formula C14H21NO6S
Exact Mass 331.108959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LuFuQKauuxh
Name N-[2-(3,4-Dimethoxyphenyl)ethyl]-N-methanesulfonylalanine
Comments Less than 3 mono-isotopic peaks
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Formula C14H21NO6S
InChI InChI=1S/C14H21NO6S/c1-10(14(16)17)15(22(4,18)19)8-7-11-5-6-12(20-2)13(9-11)21-3/h5-6,9-10H,7-8H2,1-4H3,(H,16,17)
InChIKey UGBOGHFNKVEHJG-UHFFFAOYSA-N
Molecular Weight 331.383 g/mol
SMILES OC(C(N(S(=O)(=O)C)CCc1cc(OC)c(cc1)OC)C)=O
SPLASH splash10-0udi-0902000000-94ea943b5e5bc1db02e1
Source of Spectrum H1-45-1125-1
Synonyms N-[2-(3,4-dimethoxyphenyl)ethyl]-N-(methylsulfonyl)alanine
Wiley ID 758307