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3,3-Dimethyl-1,6-heptadiene
SpectraBase Compound ID DsXNOzGWHGp
InChI InChI=1S/C9H16/c1-5-7-8-9(3,4)6-2/h5-6H,1-2,7-8H2,3-4H3
InChIKey YWOCVROBRVNVFV-UHFFFAOYSA-N
Mol Weight 124.23 g/mol
Molecular Formula C9H16
Exact Mass 124.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID NpHtemaxmh
Name 3,3-Dimethyl-1,6-heptadiene
CAS Registry Number 68701-61-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16
InChI InChI=1S/C9H16/c1-5-7-8-9(3,4)6-2/h5-6H,1-2,7-8H2,3-4H3
InChIKey YWOCVROBRVNVFV-UHFFFAOYSA-N
Molecular Weight 124.227 g/mol
SMILES CC(C=C)(C)CCC=C
SPLASH splash10-05mo-9000000000-253a19f108eb5c09b731
Source of Spectrum HE-1982-0-0
Synonyms 1,6-Heptadiene, 3,3-dimethyl- 3,3-Dimethylhepta-1,6-diene
Wiley ID 1129179