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1-(5-tert-Butyl-2-methyl-1H-pyrrol-3-yl)-3,3-dimethylbutan-1-one
SpectraBase Compound ID 13f9Z4magUO
InChI InChI=1S/C15H25NO/c1-10-11(12(17)9-14(2,3)4)8-13(16-10)15(5,6)7/h8,16H,9H2,1-7H3
InChIKey UEENJMMTZYNXDK-UHFFFAOYSA-N
Mol Weight 235.37 g/mol
Molecular Formula C15H25NO
Exact Mass 235.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4AftcOLwDOA
Name 1-(5-tert-Butyl-2-methyl-1H-pyrrol-3-yl)-3,3-dimethylbutan-1-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.193614428 u
Formula C15H25NO
InChI InChI=1S/C15H25NO/c1-10-11(12(17)9-14(2,3)4)8-13(16-10)15(5,6)7/h8,16H,9H2,1-7H3
InChIKey UEENJMMTZYNXDK-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1021/jo400533j
Molecular Weight 235.371 g/mol
Quality 87
SMILES N1C(=C(C=C1C(C)(C)C)C(=O)CC(C)(C)C)C
SPLASH splash10-03k9-0940000000-339b84838d8ad1c22f1f
Source of Spectrum JOC-78-4927-7m (DOI: 10.1021/jo400533j)
Wiley ID 1912150