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(2S)-2-(3,4-dimethoxyphenyl)-N-[(1R)-2-methoxy-1-phenyl-ethyl]-3-phenyl-propan-1-amine
SpectraBase Compound ID 2YNnfYrgVu9
InChI InChI=1S/C26H31NO3/c1-28-19-24(21-12-8-5-9-13-21)27-18-23(16-20-10-6-4-7-11-20)22-14-15-25(29-2)26(17-22)30-3/h4-15,17,23-24,27H,16,18-19H2,1-3H3/t23-,24+/m1/s1
InChIKey JPHSJOUVZOIOCR-RPWUZVMVSA-N
Mol Weight 405.54 g/mol
Molecular Formula C26H31NO3
Exact Mass 405.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JhPWfvk8JAa
Name (2S)-2-(3,4-dimethoxyphenyl)-N-[(1R)-2-methoxy-1-phenyl-ethyl]-3-phenyl-propan-1-amine
Alternate Name(s) (2S)-2-(3,4-dimethoxyphenyl)-N-[(1R)-2-methoxy-1-phenylethyl]-3-phenyl-1-propanamine [(2S)-2-(3,4-dimethoxyphenyl)-3-phenyl-propyl]-[(1R)-2-methoxy-1-phenyl-ethyl]amine
Comments Less than 3 mono-isotopic peaks
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Formula C26H31NO3
InChI InChI=1S/C26H31NO3/c1-28-19-24(21-12-8-5-9-13-21)27-18-23(16-20-10-6-4-7-11-20)22-14-15-25(29-2)26(17-22)30-3/h4-15,17,23-24,27H,16,18-19H2,1-3H3/t23-,24+/m1/s1
InChIKey JPHSJOUVZOIOCR-RPWUZVMVSA-N
Molecular Weight 405.538 g/mol
SMILES N(C[C@](c1cc(OC)c(cc1)OC)(Cc1ccccc1)[H])[C@](c1ccccc1)(COC)[H]
SPLASH splash10-000i-0900000000-73260153f425808ea95f
Source of Spectrum QC-11-3784-2
Wiley ID 860167