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N-BUTYL-3-CHLORO-4-PHENYLPYRROLE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

N-BUTYL-3-CHLORO-4-PHENYLPYRROLE
SpectraBase Compound ID 5XtiFbm5wrk
InChI InChI=1S/C14H16ClN/c1-2-3-9-16-10-13(14(15)11-16)12-7-5-4-6-8-12/h4-8,10-11H,2-3,9H2,1H3
InChIKey FXABZWAWHHLRBY-UHFFFAOYSA-N
Mol Weight 233.74 g/mol
Molecular Formula C14H16ClN
Exact Mass 233.097127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4SZA8YawMVa
Name 1-butyl-3-chloranyl-4-phenyl-pyrrole
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16ClN
InChI InChI=1S/C14H16ClN/c1-2-3-9-16-10-13(14(15)11-16)12-7-5-4-6-8-12/h4-8,10-11H,2-3,9H2,1H3
InChIKey FXABZWAWHHLRBY-UHFFFAOYSA-N
Molecular Weight 233.742 g/mol
SMILES c1(c(c[n](c1)CCCC)Cl)-c1ccccc1
SPLASH splash10-0a59-0790000000-9f2ba2c5ef48f3ffc9eb
Source of Spectrum KC-0-744-19
Synonyms 1-butyl-3-chloro-4-phenyl-pyrrole
Wiley ID 780748