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Benzene, (1-methylheptyl)-
SpectraBase Compound ID 2cWoDBTTZsw
InChI InChI=1S/C14H22/c1-3-4-5-7-10-13(2)14-11-8-6-9-12-14/h6,8-9,11-13H,3-5,7,10H2,1-2H3
InChIKey GTYIGAUPHJCMLF-UHFFFAOYSA-N
Mol Weight 190.33 g/mol
Molecular Formula C14H22
Exact Mass 190.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CAD0AJU7jdR
Name Octan-2-ylbenzene
Appearance Colourless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 190.172150708 u
Formula C14H22
InChI InChI=1S/C14H22/c1-3-4-5-7-10-13(2)14-11-8-6-9-12-14/h6,8-9,11-13H,3-5,7,10H2,1-2H3
InChIKey GTYIGAUPHJCMLF-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/anie.201707914
Molecular Weight 190.330 g/mol
Quality 100
SMILES CC(CCCCCC)C1=CC=CC=C1
SPLASH splash10-0a4i-1900000000-b4568b1ea7030dd40428
Source of Spectrum ACI-56-SM22-48 (DOI: 10.1002/anie.201707914)
Wiley ID 1896470