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1-(TERT.-BUTOXYCARBONYL)-4-(3'-METHYL-1'-PHENYLTHIOBUT-2'-ENYL)-INDOLE
SpectraBase Compound ID EcVjYfXaebQ
InChI InChI=1S/C24H27NO2S/c1-17(2)16-22(28-18-10-7-6-8-11-18)20-12-9-13-21-19(20)14-15-25(21)23(26)27-24(3,4)5/h6-16,22H,1-5H3
InChIKey GOSIDQQFVMINAB-UHFFFAOYSA-N
Mol Weight 393.55 g/mol
Molecular Formula C24H27NO2S
Exact Mass 393.17625 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Aja2iciXPLz
Name 1-(t-butoxycarbonyl)-4-(3'-methyl-1'-phenylthiobut-2'-enyl)indole
Alternate Name(s) tert-Butyl 4-[3-methyl-1-(phenylsulfanyl)-2-butenyl]-1H-indole-1-carboxylate
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Formula C24H27NO2S
InChI InChI=1S/C24H27NO2S/c1-17(2)16-22(28-18-10-7-6-8-11-18)20-12-9-13-21-19(20)14-15-25(21)23(26)27-24(3,4)5/h6-16,22H,1-5H3
InChIKey GOSIDQQFVMINAB-UHFFFAOYSA-N
Molecular Weight 393.545 g/mol
SMILES C([n]1c2c(c(C(C=C(C)C)Sc3ccccc3)ccc2)cc1)(OC(C)(C)C)=O
SPLASH splash10-004i-3290000000-872d82e69b10585b3db7
Source of Spectrum B-45-99-0
Wiley ID 1366327