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2-Methyl-5-(3-methylphenyl)tetrahydrofuran

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

2-Methyl-5-(3-methylphenyl)tetrahydrofuran
SpectraBase Compound ID 6e6XthOZxnv
InChI InChI=1S/C12H16O/c1-9-4-3-5-11(8-9)12-7-6-10(2)13-12/h3-5,8,10,12H,6-7H2,1-2H3/t10-,12-/m1/s1
InChIKey VGBXMBSFXMHTIS-ZYHUDNBSSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GbwTFjkczZY
Name 2-Methyl-5-(3-methylphenyl)tetrahydrofuran
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 176.120115134 u
Formula C12H16O
InChI InChI=1S/C12H16O/c1-9-4-3-5-11(8-9)12-7-6-10(2)13-12/h3-5,8,10,12H,6-7H2,1-2H3/t10-,12-/m1/s1
InChIKey VGBXMBSFXMHTIS-ZYHUDNBSSA-N
Molecular Weight 176.259 g/mol
SMILES [C@]1(C=2C=C(C=CC2)C)(O[C@@](CC1)(C)[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.836573