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3,4-Bis(2-hydroxy-2-methylpropyl)-1-(4-methylphenyl)pyrrole
SpectraBase Compound ID 7urMRf455dL
InChI InChI=1S/C19H27NO2/c1-14-6-8-17(9-7-14)20-12-15(10-18(2,3)21)16(13-20)11-19(4,5)22/h6-9,12-13,21-22H,10-11H2,1-5H3
InChIKey CBWBGJULJFTWSH-UHFFFAOYSA-N
Mol Weight 301.43 g/mol
Molecular Formula C19H27NO2
Exact Mass 301.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I7zWe7ZzBcB
Name 3,4-Bis(2-hydroxy-2-methylpropyl)-1-(4-methylphenyl)pyrrole
Alternate Name(s) 1-[4-(2-hydroxy-2-methylpropyl)-1-(4-methylphenyl)-1H-pyrrol-3-yl]-2-methyl-2-propanol
Comments Less than 3 mono-isotopic peaks
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Formula C19H27NO2
InChI InChI=1S/C19H27NO2/c1-14-6-8-17(9-7-14)20-12-15(10-18(2,3)21)16(13-20)11-19(4,5)22/h6-9,12-13,21-22H,10-11H2,1-5H3
InChIKey CBWBGJULJFTWSH-UHFFFAOYSA-N
Molecular Weight 301.430 g/mol
SMILES OC(Cc1c[n](cc1CC(O)(C)C)-c1ccc(cc1)C)(C)C
SPLASH splash10-00di-0090000000-c8a5af11639c3b786cca
Source of Spectrum QE-7-2904-10
Wiley ID 845818