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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 11MbU49dnvt
Name 2-(2-nitro-1-phenyl-ethyl)-1H-pyrrole
CAS Registry Number 112616-92-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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-0900000000-6da440cdaf52963e22e8
Source of Spectrum KC-61-11755-7
Synonyms 2-(2-Nitro-1-phenylethyl)-1H-pyrrole
Wiley ID 1631594