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N-{[4-(2-THIENYL)-1H-PYRROL-2-YL]-METHYL}-1-BUTANAMINE
SpectraBase Compound ID 1Mz7LFWERdV
InChI InChI=1S/C13H18N2S/c1-2-3-6-14-10-12-8-11(9-15-12)13-5-4-7-16-13/h4-5,7-9,14-15H,2-3,6,10H2,1H3
InChIKey IMVQELZEOUWTIE-UHFFFAOYSA-N
Mol Weight 234.36 g/mol
Molecular Formula C13H18N2S
Exact Mass 234.11907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KoefouWKJci
Name N-{[4-(2'-Thienyl)-1H-pyrrol-2'-yl]methyl}-1-butanamine
Alternate Name(s) N-butyl-N-{[4-(2-thienyl)-1H-pyrrol-2-yl]methyl}amine N-{[4-(2-thienyl)-1H-pyrrol-2-yl]methyl}-1-butanamine
Comments Less than 3 mono-isotopic peaks
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Formula C13H18N2S
InChI InChI=1S/C13H18N2S/c1-2-3-6-14-10-12-8-11(9-15-12)13-5-4-7-16-13/h4-5,7-9,14-15H,2-3,6,10H2,1H3
InChIKey IMVQELZEOUWTIE-UHFFFAOYSA-N
Molecular Weight 234.361 g/mol
SMILES N(Cc1cc(c[nH]1)-c1sccc1)CCCC
SPLASH splash10-03di-0900000000-c588f74a24f29ad509d9
Source of Spectrum B-55-794-9
Wiley ID 1516966