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2,5-Dimethylphenethylamine 2-methylbenzyl

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

2,5-Dimethylphenethylamine 2-methylbenzyl
SpectraBase Compound ID 2SalZt0FirV
InChI InChI=1S/C18H23N/c1-14-8-9-16(3)17(12-14)10-11-19-13-18-7-5-4-6-15(18)2/h4-9,12,19H,10-11,13H2,1-3H3
InChIKey RIFZUPFUQYHPIV-UHFFFAOYSA-N
Mol Weight 253.39 g/mol
Molecular Formula C18H23N
Exact Mass 253.18305 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9ybGYkTauBA
Name 2,5-Dimethylphenethylamine 2-methylbenzyl
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 253.183049745 u
Formula C18H23N
InChI InChI=1S/C18H23N/c1-14-8-9-16(3)17(12-14)10-11-19-13-18-7-5-4-6-15(18)2/h4-9,12,19H,10-11,13H2,1-3H3
InChIKey RIFZUPFUQYHPIV-UHFFFAOYSA-N
Molecular Weight 253.389 g/mol
SMILES C=1(C(=CC=C(C1)C)C)CCNCC1=C(C=CC=C1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.960575