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Ethanone, 1-[4-(4-bromophenyl)-2,2,4,6-tetramethyl-3,4-dihydro-2H-quinolin-1-yl]-
SpectraBase Compound ID 1htkOU46y46
InChI InChI=1S/C21H24BrNO/c1-14-6-11-19-18(12-14)21(5,16-7-9-17(22)10-8-16)13-20(3,4)23(19)15(2)24/h6-12H,13H2,1-5H3
InChIKey WVAXDHRFGWSJSE-UHFFFAOYSA-N
Mol Weight 386.33 g/mol
Molecular Formula C21H24BrNO
Exact Mass 385.104127 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JNSoQ4micck
Name Ethanone, 1-[4-(4-bromophenyl)-2,2,4,6-tetramethyl-3,4-dihydro-2H-quinolin-1-yl]-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 385.104127396 u
Formula C21H24BrNO
InChI InChI=1S/C21H24BrNO/c1-14-6-11-19-18(12-14)21(5,16-7-9-17(22)10-8-16)13-20(3,4)23(19)15(2)24/h6-12H,13H2,1-5H3
InChIKey WVAXDHRFGWSJSE-UHFFFAOYSA-N
Molecular Weight 386.333 g/mol
SMILES C1=2N(C(CC(C2C=C(C=C1)C)(C1=CC=C(C=C1)Br)C)(C)C)C(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.92273