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Ethyl N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methanesulfonylalaninate
SpectraBase Compound ID EMVYdG2q3w5
InChI InChI=1S/C16H25NO6S/c1-6-23-16(18)12(2)17(24(5,19)20)10-9-13-7-8-14(21-3)15(11-13)22-4/h7-8,11-12H,6,9-10H2,1-5H3/t12-/m0/s1
InChIKey ZUMVKRGNCIJFKP-LBPRGKRZSA-N
Mol Weight 359.44 g/mol
Molecular Formula C16H25NO6S
Exact Mass 359.140259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IBpKOx14nF8
Name Ethyl N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methanesulfonylalaninate
Alternate Name(s) ethyl (2S)-2-[[2-(3,4-dimethoxyphenyl)ethyl](methylsulfonyl)amino]propanoate
Comments Less than 3 mono-isotopic peaks
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Formula C16H25NO6S
InChI InChI=1S/C16H25NO6S/c1-6-23-16(18)12(2)17(24(5,19)20)10-9-13-7-8-14(21-3)15(11-13)22-4/h7-8,11-12H,6,9-10H2,1-5H3/t12-/m0/s1
InChIKey ZUMVKRGNCIJFKP-LBPRGKRZSA-N
Molecular Weight 359.437 g/mol
SMILES [C@](N(S(=O)(=O)C)CCc1cc(OC)c(cc1)OC)(C(=O)OCC)(C)[H]
SPLASH splash10-0a4i-9001000000-e4dc6e6e89148c046977
Source of Spectrum H1-45-1128-0
Wiley ID 758295