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1,2-bis(4-methylpent-1-ynyl)cyclohept-1-ene
SpectraBase Compound ID 3d16RpWYYru
InChI InChI=1S/C19H28/c1-16(2)10-8-14-18-12-6-5-7-13-19(18)15-9-11-17(3)4/h16-17H,5-7,10-13H2,1-4H3
InChIKey MCWVQXNLNCBRHK-UHFFFAOYSA-N
Mol Weight 256.43 g/mol
Molecular Formula C19H28
Exact Mass 256.219101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GMEK98P0KU8
Name 1,2-bis(4-methylpent-1-ynyl)cyclohept-1-ene
Alternate Name(s) 1,2-bis(4-methylpent-1-yn-1-yl)cyclohept-1-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28
InChI InChI=1S/C19H28/c1-16(2)10-8-14-18-12-6-5-7-13-19(18)15-9-11-17(3)4/h16-17H,5-7,10-13H2,1-4H3
InChIKey MCWVQXNLNCBRHK-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201700231
Molecular Weight 256.433 g/mol
SMILES C1CC(=C(CCC1)C#CCC(C)C)C#CCC(C)C
SPLASH splash10-0a4i-0790000000-325b42a5ec3f6c338eaf
Source of Spectrum ASC-359-1637/SM7-1f
Wiley ID 1807586