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(+)-[2S,1'S,2'S]-N-(2'-Hydroxy-1'-methyl-2'-phenylethyl)-2-(3,4-methylenedioxyphenyl)-N-methyl-4-pentenamide
SpectraBase Compound ID 6cwxZbD9q2
InChI InChI=1S/C22H25NO4/c1-4-8-18(17-11-12-19-20(13-17)27-14-26-19)22(25)23(3)15(2)21(24)16-9-6-5-7-10-16/h4-7,9-13,15,18,21,24H,1,8,14H2,2-3H3/t15-,18+,21+/m1/s1
InChIKey JKXFFRVYODSKCI-YWMUFLPLSA-N
Mol Weight 367.45 g/mol
Molecular Formula C22H25NO4
Exact Mass 367.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KpfdK2iHspm
Name (+)-[2S,1'S,2'S]-N-(2'-Hydroxy-1'-methyl-2'-phenylethyl)-2-(3,4-methylenedioxyphenyl)-N-methyl-4-pentenamide
Alternate Name(s) (+)-[2S,1'R,2'R]-N-(2'-Hydroxy-1'-methyl-2'-phenylethyl)-2-(3,4-methylenedioxyphenyl)-N-methyl-4-pentenamide (2S)-2-(1,3-benzodioxol-5-yl)-N-[(1S,2S)-2-hydroxy-1-methyl-2-phenylethyl]-N-methyl-4-pentenamide (S)-2-Benzo[1,3]dioxol-5-yl-pent-4-enoic acid ((1R,2R)-2-hydroxy-1-methyl-2-phenyl-ethyl)-methyl-amide
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Formula C22H25NO4
InChI InChI=1S/C22H25NO4/c1-4-8-18(17-11-12-19-20(13-17)27-14-26-19)22(25)23(3)15(2)21(24)16-9-6-5-7-10-16/h4-7,9-13,15,18,21,24H,1,8,14H2,2-3H3/t15-,18+,21+/m1/s1
InChIKey JKXFFRVYODSKCI-YWMUFLPLSA-N
Molecular Weight 367.445 g/mol
SMILES O[C@@]([C@](N(C([C@](c1cc2OCOc2cc1)(CC=C)[H])=O)C)(C)[H])(c1ccccc1)[H]
SPLASH splash10-0uxt-2930000000-8d10a36b639ff2dcd0a8
Source of Spectrum QC-10-1952-3
Wiley ID 871428