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1-Isopropyl-3-chloro-2-cyano-5-phenylpyrrole
SpectraBase Compound ID BqeRa2nFhcp
InChI InChI=1S/C14H13ClN2/c1-10(2)17-13(8-12(15)14(17)9-16)11-6-4-3-5-7-11/h3-8,10H,1-2H3
InChIKey TXLKPKJDZMLBFX-UHFFFAOYSA-N
Mol Weight 244.72 g/mol
Molecular Formula C14H13ClN2
Exact Mass 244.076726 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8TM9ByqLFK
Name 1-Isopropyl-3-chloro-2-cyano-5-phenylpyrrole
Alternate Name(s) 3-Chloro-1-isopropyl-5-phenyl-1H-pyrrole-2-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13ClN2
InChI InChI=1S/C14H13ClN2/c1-10(2)17-13(8-12(15)14(17)9-16)11-6-4-3-5-7-11/h3-8,10H,1-2H3
InChIKey TXLKPKJDZMLBFX-UHFFFAOYSA-N
Molecular Weight 244.725 g/mol
SMILES c1([n](c(cc1Cl)-c1ccccc1)C(C)C)C#N
SPLASH splash10-0udi-0190000000-b852948df379f374a2fa
Source of Spectrum KC-61-2885-21
Wiley ID 1628315