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4,4,9,9-tetramethyldodeca-1,11-dien-5,7-diyne
SpectraBase Compound ID 4eDEx1yStyb
InChI InChI=1S/C16H22/c1-7-11-15(3,4)13-9-10-14-16(5,6)12-8-2/h7-8H,1-2,11-12H2,3-6H3
InChIKey JBZNCUUCNMOBAY-UHFFFAOYSA-N
Mol Weight 214.35 g/mol
Molecular Formula C16H22
Exact Mass 214.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3UbrWLEDIKU
Name 4,4,9,9-tetramethyldodeca-1,11-dien-5,7-diyne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22
InChI InChI=1S/C16H22/c1-7-11-15(3,4)13-9-10-14-16(5,6)12-8-2/h7-8H,1-2,11-12H2,3-6H3
InChIKey JBZNCUUCNMOBAY-UHFFFAOYSA-N
Instrument Name Finnigan 8430
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.9.5
Molecular Weight 214.352 g/mol
SMILES C(C#CC#CC(CC=C)(C)C)(CC=C)(C)C
SPLASH splash10-00tf-5900000000-c0f20e09014b202160a2
Source of Spectrum BJO-9-SM6-19
Wiley ID 1865091