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(2S)-N"-[(3S)-3-(1,2,3,4-tetrahydroisoquinolinolyl)carbonyl]-phenylalanine tert-butyl ester
SpectraBase Compound ID DafxDeY3epL
InChI InChI=1S/C23H28N2O3/c1-23(2,3)28-22(27)20(13-16-9-5-4-6-10-16)25-21(26)19-14-17-11-7-8-12-18(17)15-24-19/h4-12,19-20,24H,13-15H2,1-3H3,(H,25,26)/t19-,20?/m0/s1
InChIKey QAEOKLRNHOQMGR-XJDOXCRVSA-N
Mol Weight 380.49 g/mol
Molecular Formula C23H28N2O3
Exact Mass 380.209993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bz6S7qFB1lO
Name (2S)-N"-[(3S)-3-(1,2,3,4-tetrahydroisoquinolinolyl)carbonyl]-phenylalanine tert-butyl ester
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Formula C23H28N2O3
InChI InChI=1S/C23H28N2O3/c1-23(2,3)28-22(27)20(13-16-9-5-4-6-10-16)25-21(26)19-14-17-11-7-8-12-18(17)15-24-19/h4-12,19-20,24H,13-15H2,1-3H3,(H,25,26)/t19-,20?/m0/s1
InChIKey QAEOKLRNHOQMGR-XJDOXCRVSA-N
Molecular Weight 380.488 g/mol
SMILES N(C([C@]1(NCc2c(C1)cccc2)[H])=O)C(C(OC(C)(C)C)=O)Cc1ccccc1
SPLASH splash10-0089-0908000000-bd76da67045d5ca39abb
Source of Spectrum SO-0-1516-9
Synonyms (2S)-N''-[(3S)-3-(1,2,3,4-tetrahydroisoquinolinolyl)carbonyl]-phenylalanine tert-butyl ester
Wiley ID 878485