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Tert-Butyl Ester of (S) 2-(2-Methyl-5-phenyl-1H-pyrrol-1-yl)propanoic Acid
SpectraBase Compound ID 5ytGnMT5W6H
InChI InChI=1S/C18H23NO2/c1-13-11-12-16(15-9-7-6-8-10-15)19(13)14(2)17(20)21-18(3,4)5/h6-12,14H,1-5H3/t14-/m0/s1
InChIKey ROMYFMLQXMEXOQ-AWEZNQCLSA-N
Mol Weight 285.39 g/mol
Molecular Formula C18H23NO2
Exact Mass 285.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BgvLs4ZMpSM
Name Tert-Butyl Ester of (S) 2-(2-Methyl-5-phenyl-1H-pyrrol-1-yl)propanoic Acid
Alternate Name(s) Tert-Butyl Ester of 2-(2-Methyl-5-phenyl-1H-pyrrol-1-yl)butanoic Acid (S)-tert-butyl 2-(2-methyl-5-phenyl-1H-pyrrol-1-yl)propanoate
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Formula C18H23NO2
InChI InChI=1S/C18H23NO2/c1-13-11-12-16(15-9-7-6-8-10-15)19(13)14(2)17(20)21-18(3,4)5/h6-12,14H,1-5H3/t14-/m0/s1
InChIKey ROMYFMLQXMEXOQ-AWEZNQCLSA-N
Molecular Weight 285.387 g/mol
SMILES c1([n](c(cc1)C)[C@](C(OC(C)(C)C)=O)(C)[H])-c1ccccc1
SPLASH splash10-0a59-6930000000-7d1cd4708d04cb1e4391
Source of Spectrum HC-47-191-4b
Wiley ID 1734052