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3-Methyl-4-phenyl-1H-pyrrole
SpectraBase Compound ID 8vAUUZ3geWo
InChI InChI=1S/C11H11N/c1-9-7-12-8-11(9)10-5-3-2-4-6-10/h2-8,12H,1H3
InChIKey WGLKMXOTGOECNA-UHFFFAOYSA-N
Mol Weight 157.22 g/mol
Molecular Formula C11H11N
Exact Mass 157.089149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5V14iiC60C8
Name 3-Methyl-4-phenyl-1H-pyrole
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 157.089149358 u
Formula C11H11N
InChI InChI=1S/C11H11N/c1-9-7-12-8-11(9)10-5-3-2-4-6-10/h2-8,12H,1H3
InChIKey WGLKMXOTGOECNA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 157.216 g/mol
Nominal Mass 157 u
Quality 892
Retention Index 1254
SMILES C=1(C=2C=CC=CC2)C(=CNC1)C
SPLASH splash10-0a4i-4900000000-7c6527d9660e2d89d50e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 3-Methyl-4-phenyl-1H-pyrrole
Technique GC/MS
Wiley ID DD2024_030539