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(5S)-5-methyl-3-methylene-1-heptyne
SpectraBase Compound ID 9FgGecbWAuT
InChI InChI=1S/C9H14/c1-5-8(3)7-9(4)6-2/h1,9H,3,6-7H2,2,4H3/t9-/m0/s1
InChIKey AQRDDBCFGMYUCK-VIFPVBQESA-N
Mol Weight 122.21 g/mol
Molecular Formula C9H14
Exact Mass 122.10955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EdGKlFwLF5r
Name (5S)-5-methyl-3-methylene-1-heptyne
Comments Less than 3 mono-isotopic peaks
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Formula C9H14
InChI InChI=1S/C9H14/c1-5-8(3)7-9(4)6-2/h1,9H,3,6-7H2,2,4H3/t9-/m0/s1
InChIKey AQRDDBCFGMYUCK-VIFPVBQESA-N
Molecular Weight 122.211 g/mol
SMILES C(#C)C(=C)C[C@](CC)(C)[H]
SPLASH splash10-0a4i-0900000000-6e1c4aba9060533d5090
Source of Spectrum SO-0-634-6
Synonyms (5S)-5-methyl-3-methylene-hept-1-yne (5S)-5-methyl-3-methylidene-hept-1-yne 2-[(2S)-2-methylbutyl]but-1-en-3-yne
Wiley ID 1542382