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Benzene,(1-butylheptyl)-
SpectraBase Compound ID K8EP07RJ5yh
InChI InChI=1S/C17H28/c1-3-5-7-9-13-16(12-6-4-2)17-14-10-8-11-15-17/h8,10-11,14-16H,3-7,9,12-13H2,1-2H3
InChIKey RRPCXIBGXYGQNC-UHFFFAOYSA-N
Mol Weight 232.41 g/mol
Molecular Formula C17H28
Exact Mass 232.219101 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JTkw2HoXqa
Name Benzene,(1-butylheptyl)-
CAS Registry Number 4537-15-9
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 232.219100902 u
Formula C17H28
InChI InChI=1S/C17H28/c1-3-5-7-9-13-16(12-6-4-2)17-14-10-8-11-15-17/h8,10-11,14-16H,3-7,9,12-13H2,1-2H3
InChIKey RRPCXIBGXYGQNC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 232.411 g/mol
Nominal Mass 232 u
Quality 980
SMILES C=1(C(CCCCCC)CCCC)C=CC=CC1
SPLASH splash10-0006-9500000000-b9cf1cdfe85a9dbc731e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms undecan-5-ylbenzene
Technique GC/MS
Wiley ID DD2024_034630