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3-METHYL-1-PHENYLMETHYLPYRROLE
SpectraBase Compound ID 4wqLxqlQM0
InChI InChI=1S/C12H13N/c1-11-7-8-13(9-11)10-12-5-3-2-4-6-12/h2-9H,10H2,1H3
InChIKey XYGAFYAVBBWQIU-UHFFFAOYSA-N
Mol Weight 171.24 g/mol
Molecular Formula C12H13N
Exact Mass 171.104799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GUXqt4luJSh
Name 1-Benzyl-3-methyl-1H-pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N
InChI InChI=1S/C12H13N/c1-11-7-8-13(9-11)10-12-5-3-2-4-6-12/h2-9H,10H2,1H3
InChIKey XYGAFYAVBBWQIU-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 6890 GC Plus
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0006.109
Molecular Weight 171.243 g/mol
SMILES c1(ccccc1)C[n]1cc(cc1)C
SPLASH splash10-006x-9600000000-ad9b8116df157cd85d1f
Source of Spectrum ARK-2005-95-2
Wiley ID 1870863