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2,5-Dimethyl-N-(2-phenylethyl)pyrrole
SpectraBase Compound ID 5h9gye8xeSV
InChI InChI=1S/C14H17N/c1-12-8-9-13(2)15(12)11-10-14-6-4-3-5-7-14/h3-9H,10-11H2,1-2H3
InChIKey PLDQUNMUOIQIEP-UHFFFAOYSA-N
Mol Weight 199.3 g/mol
Molecular Formula C14H17N
Exact Mass 199.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BTHMZBwJz4M
Name 2,5-Dimethyl-N-(2-phenylethyl)pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17N
InChI InChI=1S/C14H17N/c1-12-8-9-13(2)15(12)11-10-14-6-4-3-5-7-14/h3-9H,10-11H2,1-2H3
InChIKey PLDQUNMUOIQIEP-UHFFFAOYSA-N
Instrument Name Agilent 7890B-5977A
Ionization Type EI
Literature Reference DOI 10.1002/cbic.202000503
Molecular Weight 199.297 g/mol
SMILES c1cc(ccc1)CC[n]1c(ccc1C)C
SPLASH splash10-0a4i-3900000000-0d652a37b5da01b08be4
Source of Spectrum CBC-21-3611-60
Thin-Layer Chromatography Rf = 0.31 (cyclohexane/ethyl acetate, 30:1)
Wiley ID 1855998