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N-]{1-](5-]Chloro-]2-]n-]hexylphenyl)ethyl}-]4-]methoxyaniline

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

N-]{1-](5-]Chloro-]2-]n-]hexylphenyl)ethyl}-]4-]methoxyaniline
SpectraBase Compound ID I6xNbjaVXgV
InChI InChI=1S/C21H28ClNO/c1-4-5-6-7-8-17-9-10-18(22)15-21(17)16(2)23-19-11-13-20(24-3)14-12-19/h9-16,23H,4-8H2,1-3H3
InChIKey LBUZDBKBMWPLLR-UHFFFAOYSA-N
Mol Weight 345.91 g/mol
Molecular Formula C21H28ClNO
Exact Mass 345.185942 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FnuGwzeXFjE
Name N-]{1-](5-]Chloro-]2-]N-]hexylphenyl)ethyl}-]4-]methoxyaniline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 345.185942225 u
Formula C21H28ClNO
InChI InChI=1S/C21H28ClNO/c1-4-5-6-7-8-17-9-10-18(22)15-21(17)16(2)23-19-11-13-20(24-3)14-12-19/h9-16,23H,4-8H2,1-3H3
InChIKey LBUZDBKBMWPLLR-UHFFFAOYSA-N
Molecular Weight 345.914 g/mol
SMILES C=1C(C(NC=2C=CC(=CC2)OC)C)=C(CCCCCC)C=CC1Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.917683