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1-Butyl-4-(1-methylpentyl)benzene
SpectraBase Compound ID 35BcC8wHND7
InChI InChI=1S/C16H26/c1-4-6-8-14(3)16-12-10-15(11-13-16)9-7-5-2/h10-14H,4-9H2,1-3H3
InChIKey FYJHOLXIUWURRX-UHFFFAOYSA-N
Mol Weight 218.38 g/mol
Molecular Formula C16H26
Exact Mass 218.203451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7BAbxgEVr0i
Name 1-Butyl-4-(1-methylpentyl)benzene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26
InChI InChI=1S/C16H26/c1-4-6-8-14(3)16-12-10-15(11-13-16)9-7-5-2/h10-14H,4-9H2,1-3H3
InChIKey FYJHOLXIUWURRX-UHFFFAOYSA-N
Molecular Weight 218.384 g/mol
SMILES c1(ccc(cc1)CCCC)C(CCCC)C
SPLASH splash10-03di-0910000000-3cf8541ddbdd3faa1cf3
Source of Spectrum F-54-9327-25
Synonyms 1-butyl-4-hexan-2-yl-benzene
Wiley ID 808061