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3-(3',4'-Diisobutyl-1'-methylpyrrol-2'-yl)acrolein
SpectraBase Compound ID KfCTmK5tLek
InChI InChI=1S/C16H25NO/c1-12(2)9-14-11-17(5)16(7-6-8-18)15(14)10-13(3)4/h6-8,11-13H,9-10H2,1-5H3/b7-6+
InChIKey JVFSWFAAMNVZSV-VOTSOKGWSA-N
Mol Weight 247.38 g/mol
Molecular Formula C16H25NO
Exact Mass 247.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JKBavMMX1y8
Name 3-(3',4'-Diisobutyl-1'-methylpyrrol-2'-yl)acrolein
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25NO
InChI InChI=1S/C16H25NO/c1-12(2)9-14-11-17(5)16(7-6-8-18)15(14)10-13(3)4/h6-8,11-13H,9-10H2,1-5H3/b7-6+
InChIKey JVFSWFAAMNVZSV-VOTSOKGWSA-N
Molecular Weight 247.382 g/mol
SMILES c1(c(c[n](c1\C=C\C=O)C)CC(C)C)CC(C)C
SPLASH splash10-0udl-5690000000-eeb12870792d52385813
Source of Spectrum U-1994-508-22
Synonyms (2E)-3-(3,4-diisobutyl-1-methyl-1H-pyrrol-2-yl)-2-propenal
Wiley ID 765790