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E and Z isomers of 2,6,7,7-Tetramethyl-2,5-octadiene
SpectraBase Compound ID BwRawAcBAjg
InChI InChI=1S/C12H22/c1-10(2)8-7-9-11(3)12(4,5)6/h8-9H,7H2,1-6H3/b11-9+
InChIKey DCRXNQRLXFSWMO-PKNBQFBNSA-N
Mol Weight 166.31 g/mol
Molecular Formula C12H22
Exact Mass 166.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Oh3yEkr7C0
Name E and Z isomers of 2,6,7,7-Tetramethyl-2,5-octadiene
CAS Registry Number 68974-94-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22
InChI InChI=1S/C12H22/c1-10(2)8-7-9-11(3)12(4,5)6/h8-9H,7H2,1-6H3/b11-9+
InChIKey DCRXNQRLXFSWMO-PKNBQFBNSA-N
Molecular Weight 166.308 g/mol
SMILES C(\C(=C\CC=C(C)C)C)(C)(C)C
SPLASH splash10-05mo-9100000000-3db64ae7ef4aaafd41f6
Source of Spectrum J-44-1161-0
Synonyms (5E)-2,6,7,7-tetramethyl-2,5-octadiene
Wiley ID 1163255