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Benzene,(1-propyloctyl)-
SpectraBase Compound ID CMwXD1FD5Ui
InChI InChI=1S/C17H28/c1-3-5-6-7-9-13-16(12-4-2)17-14-10-8-11-15-17/h8,10-11,14-16H,3-7,9,12-13H2,1-2H3
InChIKey NSQAXMRLBNXEHK-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 KSNc3nJEWUv
Name (1-Propyloctyl)benzene
Alternate Name(s) 1-Propyloctylbenzene 4-Phenylundecane Benzene, (1-propyloctyl)- undecan-4-ylbenzene Undecane, 4-phenyl-
CAS Registry Number 4536-86-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H28
InChI InChI=1S/C17H28/c1-3-5-6-7-9-13-16(12-4-2)17-14-10-8-11-15-17/h8,10-11,14-16H,3-7,9,12-13H2,1-2H3
InChIKey NSQAXMRLBNXEHK-UHFFFAOYSA-N
Molecular Weight 232.411 g/mol
SMILES CCCC(CCCCCCC)c1ccccc1
SPLASH splash10-0006-9300000000-07d29320769dceea71e0
Source of Spectrum HE-1982-0-0
Wiley ID 1234487