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Tert-Butyl Ester of (S)-2-(2,5-Dimethyl-1H-pyrrol-1-yl)propionic Acid
SpectraBase Compound ID E5JK9lqTMMc
InChI InChI=1S/C13H21NO2/c1-9-7-8-10(2)14(9)11(3)12(15)16-13(4,5)6/h7-8,11H,1-6H3/t11-/m0/s1
InChIKey LBYRKPWULZVZSS-NSHDSACASA-N
Mol Weight 223.32 g/mol
Molecular Formula C13H21NO2
Exact Mass 223.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4xFz0ZEuZc
Name Tert-Butyl Ester of (S)-2-(2,5-Dimethyl-1H-pyrrol-1-yl)propionic Acid
Alternate Name(s) Tert-Butyl Ester of 2-(2,5-Dimethyl-1H-pyrrol-1-yl)propionic Acid (S)-tert-butyl 2-(2,5-dimethyl-1H-pyrrol-1-yl)propanoate
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Formula C13H21NO2
InChI InChI=1S/C13H21NO2/c1-9-7-8-10(2)14(9)11(3)12(15)16-13(4,5)6/h7-8,11H,1-6H3/t11-/m0/s1
InChIKey LBYRKPWULZVZSS-NSHDSACASA-N
Molecular Weight 223.316 g/mol
SMILES [C@]([n]1c(ccc1C)C)(C(OC(C)(C)C)=O)(C)[H]
SPLASH splash10-0596-9310000000-a09f71fae6a17be1c9e5
Source of Spectrum HC-47-190-1b
Wiley ID 1734057