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3-Methylbutylbenzene

View entire compound with spectra: 13 NMR, 3 FTIR, 1 Raman, 5 MS (GC), and 2 Near IR

3-Methylbutylbenzene
SpectraBase Compound ID Ejmokq9XVhA
InChI InChI=1S/C11H16/c1-10(2)8-9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
InChIKey XNXIYYFOYIUJIW-UHFFFAOYSA-N
Mol Weight 148.25 g/mol
Molecular Formula C11H16
Exact Mass 148.125201 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID wPHl3REqC9
Name Isopentylbenzene
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 311049
CAS Registry Number 2049-94-7
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16
InChI 1S/C11H16/c1-10(2)8-9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
InChIKey XNXIYYFOYIUJIW-UHFFFAOYSA-N
Observed nucleus 13C
Purity 97%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms (3-Methyl-1-butyl)benzene Isoamylbenzene
Wiley ID SIAL_13CNMR_006265