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1H-Pyrrole-1-carboxylic acid, 2-bromo-4-hexyl-, tert-butyl ester
SpectraBase Compound ID 3zTQtonszmH
InChI InChI=1S/C15H24BrNO2/c1-5-6-7-8-9-12-10-13(16)17(11-12)14(18)19-15(2,3)4/h10-11H,5-9H2,1-4H3
InChIKey GTDVQXQNPDQOHU-UHFFFAOYSA-N
Mol Weight 330.27 g/mol
Molecular Formula C15H24BrNO2
Exact Mass 329.099042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FojY0O1MVsn
Name 1H-Pyrrole-1-carboxylic acid, 2-bromo-4-hexyl-, tert-butyl ester
CAS Registry Number 168106-33-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24BrNO2
InChI InChI=1S/C15H24BrNO2/c1-5-6-7-8-9-12-10-13(16)17(11-12)14(18)19-15(2,3)4/h10-11H,5-9H2,1-4H3
InChIKey GTDVQXQNPDQOHU-UHFFFAOYSA-N
Molecular Weight 330.266 g/mol
SMILES CC(OC([n]1c(cc(c1)CCCCCC)Br)=O)(C)C
SPLASH splash10-0a4i-9610000000-cb5ec0abe94d66017911
Synonyms 2-Bromo-4-hexyl-1-pyrrolecarboxylic acid tert-butyl ester 2-Bromo-4-hexyl-pyrrole-1-carboxylic acid tert-butyl ester tert-Butyl 2-bromanyl-4-hexyl-pyrrole-1-carboxylate tert-Butyl 2-bromo-4-hexyl-1H-pyrrole-1-carboxylate tert-Butyl 2-bromo-4-hexyl-pyrrole-1-carboxylate
Wiley ID 1475750