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2-(4-Bromophenyl)-N-cyclopropyl-N-methylpropanamide
SpectraBase Compound ID 8cwpmVkDiR6
InChI InChI=1S/C13H16BrNO/c1-9(10-3-5-11(14)6-4-10)13(16)15(2)12-7-8-12/h3-6,9,12H,7-8H2,1-2H3
InChIKey PXCSBSQORIZADU-UHFFFAOYSA-N
Mol Weight 282.18 g/mol
Molecular Formula C13H16BrNO
Exact Mass 281.041527 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 89cSqLMM05o
Name 2-(4-Bromophenyl)-N-cyclopropyl-N-methylpropanamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 281.041527138 u
Formula C13H16BrNO
InChI InChI=1S/C13H16BrNO/c1-9(10-3-5-11(14)6-4-10)13(16)15(2)12-7-8-12/h3-6,9,12H,7-8H2,1-2H3
InChIKey PXCSBSQORIZADU-UHFFFAOYSA-N
SMILES C1(Br)=CC=C(C=C1)C(C(=O)N(C1CC1)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.937173