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(+)-(S)-5-(2,4-Dimethyl-5-(ethoxycarbonyl)-1H-pyrrol-3-yl)hexanol
SpectraBase Compound ID 9hVCIrYrgiG
InChI InChI=1S/C15H25NO3/c1-5-19-15(18)14-11(3)13(12(4)16-14)10(2)8-6-7-9-17/h10,16-17H,5-9H2,1-4H3/t10-/m0/s1
InChIKey XZXHYJRVBHUIFY-JTQLQIEISA-N
Mol Weight 267.37 g/mol
Molecular Formula C15H25NO3
Exact Mass 267.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Cr9klcdt9B
Name (+)-(S)-5-(2,4-Dimethyl-5-(ethoxycarbonyl)-1H-pyrrol-3-yl)hexanol
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Formula C15H25NO3
InChI InChI=1S/C15H25NO3/c1-5-19-15(18)14-11(3)13(12(4)16-14)10(2)8-6-7-9-17/h10,16-17H,5-9H2,1-4H3/t10-/m0/s1
InChIKey XZXHYJRVBHUIFY-JTQLQIEISA-N
Molecular Weight 267.369 g/mol
SMILES OCCCC[C@@](c1c(c([nH]c1C)C(=O)OCC)C)(C)[H]
SPLASH splash10-0007-0900000000-ebb58e9612f98d17fff3
Source of Spectrum C-117-8734-14
Synonyms 5-[2',4'-Dimethyl-5'-(ethoxycarbonyl)-1H-pyrrol-3'-yl]-hexanol Ethyl 4-[(1S)-5-hydroxy-1-methylpentyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Wiley ID 1697990