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1-Benzylpyrrole
SpectraBase Compound ID KbMLsjmH1IL
InChI InChI=1S/C11H11N/c1-2-6-11(7-3-1)10-12-8-4-5-9-12/h1-9H,10H2
InChIKey FNEQHKCQXDKYEO-UHFFFAOYSA-N
Mol Weight 157.22 g/mol
Molecular Formula C11H11N
Exact Mass 157.089149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F4CH3EmAvVL
Name 1H-Pyrrole, 1-(phenylmethyl)-
CAS Registry Number 2051-97-0
Comments Less than 3 mono-isotopic peaks
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Formula C11H11N
InChI InChI=1S/C11H11N/c1-2-6-11(7-3-1)10-12-8-4-5-9-12/h1-9H,10H2
InChIKey FNEQHKCQXDKYEO-UHFFFAOYSA-N
Molecular Weight 157.216 g/mol
SMILES c1[n](ccc1)Cc1ccccc1
SPLASH splash10-0006-9400000000-2055654040e8b6b515a6
Source of Spectrum H1-45-719-0
Synonyms 1-Benzyl-1H-pyrrole 1-(Phenylmethyl)pyrrole 1-Benzylpyrrole N-Benzylpyrrole Pyrrole, 1-benzyl- EINECS 218-137-1 NSC 116806 NSC 4024
Wiley ID 758373