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2, 3-Dimethyl-5-phenyl-1H-pyrrole
SpectraBase Compound ID 9xfBU4k1TJ0
InChI InChI=1S/C12H13N/c1-9-8-12(13-10(9)2)11-6-4-3-5-7-11/h3-8,13H,1-2H3
InChIKey PKPJXOXKUCDZOD-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 3Kw87cTiJU
Name 2, 3-Dimethyl-5-phenyl-1H-pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N
InChI InChI=1S/C12H13N/c1-9-8-12(13-10(9)2)11-6-4-3-5-7-11/h3-8,13H,1-2H3
InChIKey PKPJXOXKUCDZOD-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201300477
Molecular Weight 171.243 g/mol
SMILES [nH]1c(cc(c1C)C)-c1ccccc1
SPLASH splash10-00di-0900000000-faf4405c6ac37d16ff39
Source of Spectrum ACI-52-SMS19-4q
Synonyms 2,3-Dimethyl-5-phenyl-1H-pyrrole
Wiley ID 1781215