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4-Methylhept-5-en-1-yne
SpectraBase Compound ID HpP2ZhR4ju5
InChI InChI=1S/C8H12/c1-4-6-8(3)7-5-2/h1,5,7-8H,6H2,2-3H3/b7-5+
InChIKey XTNGXLFCAAODDF-FNORWQNLSA-N
Mol Weight 108.18 g/mol
Molecular Formula C8H12
Exact Mass 108.0939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LdXMPzUoSaD
Name 4-Methylhept-5-en-1-yne
CAS Registry Number 128386-68-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12
InChI InChI=1S/C8H12/c1-4-6-8(3)7-5-2/h1,5,7-8H,6H2,2-3H3/b7-5+
InChIKey XTNGXLFCAAODDF-FNORWQNLSA-N
Molecular Weight 108.184 g/mol
SMILES C(#C)CC(\C=C\C)C
SPLASH splash10-00kf-9000000000-d63bc4eb2cf50a514d3b
Source of Spectrum C-112-5983-28
Wiley ID 1122024