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5-Methyl-5-(1'-methylethyl)-1,3,6-heptatriene
SpectraBase Compound ID 1PGDfj502E7
InChI InChI=1S/C11H18/c1-6-8-9-11(5,7-2)10(3)4/h6-10H,1-2H2,3-5H3/b9-8+
InChIKey OJWPNSYJKGRLNE-CMDGGOBGSA-N
Mol Weight 150.26 g/mol
Molecular Formula C11H18
Exact Mass 150.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CLtKGZrd8dW
Name 5-Methyl-5-(1'-methylethyl)-1,3,6-heptatriene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18
InChI InChI=1S/C11H18/c1-6-8-9-11(5,7-2)10(3)4/h6-10H,1-2H2,3-5H3/b9-8+
InChIKey OJWPNSYJKGRLNE-CMDGGOBGSA-N
Molecular Weight 150.265 g/mol
SMILES C(\C=C\C=C)(C=C)(C(C)C)C
SPLASH splash10-004l-9200000000-7b80fc12134bafc0852b
Source of Spectrum U-1995-1108-211
Synonyms (3E)-5-isopropyl-5-methyl-1,3,6-heptatriene
Wiley ID 766962