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Tert-Butyl (2S)-3-phenyl-2-(2-phenyl-4,5,6,7-tetrahydro-1H-indol-1-yl)propionate
SpectraBase Compound ID Hk2hMNXfdJf
InChI InChI=1S/C27H31NO2/c1-27(2,3)30-26(29)25(18-20-12-6-4-7-13-20)28-23-17-11-10-16-22(23)19-24(28)21-14-8-5-9-15-21/h4-9,12-15,19,25H,10-11,16-18H2,1-3H3/t25-/m0/s1
InChIKey NQOYUQJOVNDXHT-VWLOTQADSA-N
Mol Weight 401.55 g/mol
Molecular Formula C27H31NO2
Exact Mass 401.235479 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9KAqh8CJ14Q
Name Tert-Butyl (2S)-3-phenyl-2-(2-phenyl-4,5,6,7-tetrahydro-1H-indol-1-yl)propionate
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Formula C27H31NO2
InChI InChI=1S/C27H31NO2/c1-27(2,3)30-26(29)25(18-20-12-6-4-7-13-20)28-23-17-11-10-16-22(23)19-24(28)21-14-8-5-9-15-21/h4-9,12-15,19,25H,10-11,16-18H2,1-3H3/t25-/m0/s1
InChIKey NQOYUQJOVNDXHT-VWLOTQADSA-N
Molecular Weight 401.550 g/mol
SMILES c1([n](c2c(c1)CCCC2)[C@](C(OC(C)(C)C)=O)(Cc1ccccc1)[H])-c1ccccc1
SPLASH splash10-0005-9615200000-05fb3fa1906c8c71e557
Source of Spectrum HC-48-719-6c
Synonyms (S)-tert-butyl 3-phenyl-2-(2-phenyl-4,5,6,7-tetrahydro-1H-indol-1-yl)propanoate
Wiley ID 1741806