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2-n-Butyl-1-(2-iodophenyl)-1H-pyrrole
SpectraBase Compound ID GIHxn8oTqsx
InChI InChI=1S/C14H16IN/c1-2-3-7-12-8-6-11-16(12)14-10-5-4-9-13(14)15/h4-6,8-11H,2-3,7H2,1H3
InChIKey PWESFPQYUKUPAI-UHFFFAOYSA-N
Mol Weight 325.19 g/mol
Molecular Formula C14H16IN
Exact Mass 325.032745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID gSp5VEpoB6
Name 2-n-Butyl-1-(2-iodophenyl)-1H-pyrrole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16IN
InChI InChI=1S/C14H16IN/c1-2-3-7-12-8-6-11-16(12)14-10-5-4-9-13(14)15/h4-6,8-11H,2-3,7H2,1H3
InChIKey PWESFPQYUKUPAI-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol900522g
Molecular Weight 325.193 g/mol
SMILES c1[n](c(cc1)CCCC)-c1c(cccc1)I
SPLASH splash10-057i-2698000000-0911506e747eb33579dd
Source of Spectrum A1-11-2031/SMS10-5k
Synonyms 2-Butyl-1-(2-iodophenyl)-1H-pyrrole
Wiley ID 1756750