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2-[(1E)-1,3-butadienyl]-1,3,3-trimethyl-1-cyclohexene
SpectraBase Compound ID 8RzaCacfZGD
InChI InChI=1S/C13H20/c1-5-6-9-12-11(2)8-7-10-13(12,3)4/h5-6,9H,1,7-8,10H2,2-4H3/b9-6+
InChIKey BWPHCNAZKLXPHW-RMKNXTFCSA-N
Mol Weight 176.3 g/mol
Molecular Formula C13H20
Exact Mass 176.156501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3P7tZrwWCu
Name 2-[(1E)-1,3-butadienyl]-1,3,3-trimethyl-1-cyclohexene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20
InChI InChI=1S/C13H20/c1-5-6-9-12-11(2)8-7-10-13(12,3)4/h5-6,9H,1,7-8,10H2,2-4H3/b9-6+
InChIKey BWPHCNAZKLXPHW-RMKNXTFCSA-N
Molecular Weight 176.303 g/mol
SMILES C1(=C(CCCC1(C)C)C)\C=C\C=C
SPLASH splash10-0aou-5900000000-5e49a86fb0f2d01309e7
Source of Spectrum F-51-2445-20
Synonyms 2-[(1E)-buta-1,3-dienyl]-1,3,3-trimethyl-cyclohexene
Wiley ID 791263