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2,5-Dimethyl-1-phenylpyrrole
SpectraBase Compound ID D9sgjW4SRVl
InChI InChI=1S/C12H13N/c1-10-8-9-11(2)13(10)12-6-4-3-5-7-12/h3-9H,1-2H3
InChIKey JNXIFVSGXLGULI-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 JICxmr77Bui
Name 2,5-Dimethyl-1-phenylpyrrole
CAS Registry Number 83-24-9
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 171.104799423 u
Formula C12H13N
InChI InChI=1S/C12H13N/c1-10-8-9-11(2)13(10)12-6-4-3-5-7-12/h3-9H,1-2H3
InChIKey JNXIFVSGXLGULI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 171.243 g/mol
Nominal Mass 171 u
Quality 901
Retention Index 1362
SMILES C1(N2C(=CC=C2C)C)=CC=CC=C1
SPLASH splash10-00di-3900000000-f37da4fc7005c5fe0493
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1H-Pyrrole,2,5-dimethyl-1-phenyl
Technique GC/MS
Wiley ID DD2024_023300