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(2S)-2-(3,4-dimethoxyphenyl)-N-methyl-N-[(1S,2S)-1-oxidanyl-1-phenyl-propan-2-yl]butanamide

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(2S)-2-(3,4-dimethoxyphenyl)-N-methyl-N-[(1S,2S)-1-oxidanyl-1-phenyl-propan-2-yl]butanamide
SpectraBase Compound ID 1QkH3hMw5I8
InChI InChI=1S/C22H29NO4/c1-6-18(17-12-13-19(26-4)20(14-17)27-5)22(25)23(3)15(2)21(24)16-10-8-7-9-11-16/h7-15,18,21,24H,6H2,1-5H3/t15-,18-,21+/m0/s1
InChIKey AZLLBCYMWLJXSF-UQASEVPWSA-N
Mol Weight 371.48 g/mol
Molecular Formula C22H29NO4
Exact Mass 371.209658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2pjGaRLEaC
Name (2S)-2-(3,4-dimethoxyphenyl)-N-methyl-N-[(1S,2S)-1-oxidanyl-1-phenyl-propan-2-yl]butanamide
Alternate Name(s) (2S)-2-(3,4-dimethoxyphenyl)-N-[(1S,2S)-1-hydroxy-1-phenylpropan-2-yl]-N-methylbutanamide (2S)-2-(3,4-dimethoxyphenyl)-N-[(1S,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]-N-methyl-butanamide (2S)-2-(3,4-dimethoxyphenyl)-N-[(1S,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]-N-methyl-butyramide
Comments Removed - expert review: contamination (acetone))
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Formula C22H29NO4
InChI InChI=1S/C22H29NO4/c1-6-18(17-12-13-19(26-4)20(14-17)27-5)22(25)23(3)15(2)21(24)16-10-8-7-9-11-16/h7-15,18,21,24H,6H2,1-5H3/t15-,18-,21+/m0/s1
InChIKey AZLLBCYMWLJXSF-UQASEVPWSA-N
Molecular Weight 371.477 g/mol
SMILES O[C@]([C@@](N(C([C@](c1cc(OC)c(cc1)OC)(CC)[H])=O)C)(C)[H])(c1ccccc1)[H]
SPLASH splash10-0a4i-9000000000-7cd0be412cafbbf983fd
Source of Spectrum J-64-4614-2
Wiley ID 1530319