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2,3,3-trimethyl-1,4-hexadiene
SpectraBase Compound ID 1jF7arR85Od
InChI InChI=1S/C9H16/c1-6-7-9(4,5)8(2)3/h6-7H,2H2,1,3-5H3/b7-6+
InChIKey PYIDNRXQWJKATC-VOTSOKGWSA-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 9PPlBQUNCug
Name 2,3,3-trimethyl-1,4-hexadiene
CAS Registry Number 116786-17-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16
InChI InChI=1S/C9H16/c1-6-7-9(4,5)8(2)3/h6-7H,2H2,1,3-5H3/b7-6+
InChIKey PYIDNRXQWJKATC-VOTSOKGWSA-N
Molecular Weight 124.227 g/mol
SMILES C(C(\C=C\C)(C)C)(=C)C
SPLASH splash10-0api-9300000000-bd3cf26531b98e726891
Source of Spectrum K-122-155-3
Synonyms (4E)-2,3,3-trimethyl-1,4-hexadiene
Wiley ID 1129244