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2-(2-nitro-1-phenyl-ethyl)-1H-pyrrole
SpectraBase Compound ID 2nIt0snMJnd
InChI InChI=1S/C12H12N2O2/c15-14(16)9-11(12-7-4-8-13-12)10-5-2-1-3-6-10/h1-8,11,13H,9H2
InChIKey OQBKIIBFDPNSIV-UHFFFAOYSA-N
Mol Weight 216.24 g/mol
Molecular Formula C12H12N2O2
Exact Mass 216.089878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ZJZKbl7aik
Name 2-(2-nitro-1-phenyl-ethyl)-1H-pyrrole
CAS Registry Number 112616-92-9
Comments Less than 3 mono-isotopic peaks
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Formula C12H12N2O2
InChI InChI=1S/C12H12N2O2/c15-14(16)9-11(12-7-4-8-13-12)10-5-2-1-3-6-10/h1-8,11,13H,9H2
InChIKey OQBKIIBFDPNSIV-UHFFFAOYSA-N
Molecular Weight 216.240 g/mol
SMILES [nH]1cccc1C(CN(=O)=O)c1ccccc1
SPLASH splash10-014i-0920000000-6b8c84d63f9260b2b623
Source of Spectrum F-43-1120-9
Synonyms 2-(2-Nitro-1-phenylethyl)-1H-pyrrole
Wiley ID 1215514