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(S)-3-Phenyl-2-(4,5,6,7-tetrahydro-indol-1-yl)-propionic acid methyl ester
SpectraBase Compound ID BJslqzZ5Pxu
InChI InChI=1S/C18H21NO2/c1-21-18(20)17(13-14-7-3-2-4-8-14)19-12-11-15-9-5-6-10-16(15)19/h2-4,7-8,11-12,17H,5-6,9-10,13H2,1H3/t17-/m0/s1
InChIKey SQAGWHZZDIXOSA-KRWDZBQOSA-N
Mol Weight 283.37 g/mol
Molecular Formula C18H21NO2
Exact Mass 283.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mypR0JTJkm
Name (S)-3-Phenyl-2-(4,5,6,7-tetrahydro-indol-1-yl)-propionic acid methyl ester
Alternate Name(s) Methyl (2S)-3-phenyl-2-(4,5,6,7-tetrahydro-1H-indol-1-yl)propanoate N-(S)-[(Methoxycarbonyl)benzylmethyl]tetrahydroindole
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Formula C18H21NO2
InChI InChI=1S/C18H21NO2/c1-21-18(20)17(13-14-7-3-2-4-8-14)19-12-11-15-9-5-6-10-16(15)19/h2-4,7-8,11-12,17H,5-6,9-10,13H2,1H3/t17-/m0/s1
InChIKey SQAGWHZZDIXOSA-KRWDZBQOSA-N
Molecular Weight 283.371 g/mol
SMILES c12[n](ccc2CCCC1)[C@](C(=O)OC)(Cc1ccccc1)[H]
SPLASH splash10-007o-2590000000-fc9f91b5f85dbc468879
Source of Spectrum QC-7-275-3
Wiley ID 869092