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2,5-dimethyl-1-hexylpyrrole

View entire compound with spectra: 3 NMR, 1 FTIR, and 1 MS (GC)

2,5-dimethyl-1-hexylpyrrole
SpectraBase Compound ID KaHJwio8q8c
InChI InChI=1S/C12H21N/c1-4-5-6-7-10-13-11(2)8-9-12(13)3/h8-9H,4-7,10H2,1-3H3
InChIKey MFPKJLDMENDRJJ-UHFFFAOYSA-N
Mol Weight 179.31 g/mol
Molecular Formula C12H21N
Exact Mass 179.1674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3yqcDFYUW8
Name 1-Hexyl-2,5-dimethyl-1H-pyrrole
Alternate Name(s) 1-Hexyl-2,5-dimethylpyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21N
InChI InChI=1S/C12H21N/c1-4-5-6-7-10-13-11(2)8-9-12(13)3/h8-9H,4-7,10H2,1-3H3
InChIKey MFPKJLDMENDRJJ-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4gc01523a
Molecular Weight 179.307 g/mol
SMILES c1(ccc(C)[n]1CCCCCC)C
SPLASH splash10-0a6r-1900000000-d6ad9bc3fadeda0c4825
Source of Spectrum GCH-17-1095-Table2entry8
Wiley ID 1757601