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1,2,4-Trimethyl-5-(4-methylbenzyl)benzene

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

1,2,4-Trimethyl-5-(4-methylbenzyl)benzene
SpectraBase Compound ID AOV6MWG27Zg
InChI InChI=1S/C17H20/c1-12-5-7-16(8-6-12)11-17-10-14(3)13(2)9-15(17)4/h5-10H,11H2,1-4H3
InChIKey MQCFZXKZKRXZIL-UHFFFAOYSA-N
Mol Weight 224.35 g/mol
Molecular Formula C17H20
Exact Mass 224.156501 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EC2HsI05TYF
Name 1,2,4-Trimethyl-5-(4-methylbenzyl)benzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 224.156500644 u
Formula C17H20
InChI InChI=1S/C17H20/c1-12-5-7-16(8-6-12)11-17-10-14(3)13(2)9-15(17)4/h5-10H,11H2,1-4H3
InChIKey MQCFZXKZKRXZIL-UHFFFAOYSA-N
Molecular Weight 224.347 g/mol
SMILES C=1(C=C(C)C(=CC1C)C)CC=1C=CC(=CC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.952549