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Methylstyrene

View entire compound with spectra: 2 NMR, and 1 FTIR

Methylstyrene
SpectraBase Compound ID 7F2YOrBMQWz
InChI InChI=1S/3C9H10/c1-3-9-6-4-8(2)5-7-9;1-3-9-6-4-5-8(2)7-9;1-3-9-7-5-4-6-8(9)2/h3*3-7H,1H2,2H3
InChIKey ZLRVNINHFBZOJN-UHFFFAOYSA-N
Mol Weight 354.54 g/mol
Molecular Formula C27H30
Exact Mass 354.234751 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ffc5dN533HC
Name Methylstyrene
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 522864
CAS Registry Number 25013-15-4
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H30
InChI InChI=1S/3C9H10/c1-3-9-6-4-8(2)5-7-9;1-3-9-6-4-5-8(2)7-9;1-3-9-7-5-4-6-8(9)2/h3*3-7H,1H2,2H3
InChIKey ZLRVNINHFBZOJN-UHFFFAOYSA-N
Observed nucleus 13C
Purity 60% meta, 40% para and 1% ortho, 99%, contains ~50 ppm 4-tert-butylcatechol as inhibitor
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms Vinyltoluene
Wiley ID SIAL_13CNMR_010404