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1-methylnon-1-enylbenzene
SpectraBase Compound ID F2JRg15dRUs
InChI InChI=1S/C16H24/c1-3-4-5-6-7-9-12-15(2)16-13-10-8-11-14-16/h8,10-14H,3-7,9H2,1-2H3
InChIKey XJVDQKSKZGLTOY-UHFFFAOYSA-N
Mol Weight 216.37 g/mol
Molecular Formula C16H24
Exact Mass 216.187801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Z8Yz1S7WBZ
Name 1-methylnon-1-enylbenzene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 216.187800773 u
Formula C16H24
InChI InChI=1S/C16H24/c1-3-4-5-6-7-9-12-15(2)16-13-10-8-11-14-16/h8,10-14H,3-7,9H2,1-2H3
InChIKey XJVDQKSKZGLTOY-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201701766
Molecular Weight 216.368 g/mol
Quality 171
SMILES C1(C(=CCCCCCCC)C)=CC=CC=C1
SPLASH splash10-0159-1930000000-a8c0f1de04c83a1ca2a0
Sample Comments Mixture of E/Z isomers, E/Z = 53:47
Source of Spectrum K1-2018-1783-45 (DOI: 10.1002/ejoc.201701766)
Wiley ID 1894011