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2-bromanyl-N-[(1R)-1-phenylethyl]ethanamide

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2-bromanyl-N-[(1R)-1-phenylethyl]ethanamide
SpectraBase Compound ID LXkePstXOoD
InChI InChI=1S/C10H12BrNO/c1-8(12-10(13)7-11)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,12,13)/t8-/m1/s1
InChIKey RNCXLSVGMXDLOZ-MRVPVSSYSA-N
Mol Weight 242.12 g/mol
Molecular Formula C10H12BrNO
Exact Mass 241.010227 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LvMtH1upXDZ
Name 2-Bromanyl-N-[(1R)-1-phenylethyl]ethanamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 241.010227009 u
Formula C10H12BrNO
InChI InChI=1S/C10H12BrNO/c1-8(12-10(13)7-11)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,12,13)/t8-/m1/s1
InChIKey RNCXLSVGMXDLOZ-MRVPVSSYSA-N
Molecular Weight 242.116 g/mol
SMILES C(N[C@@](C1=CC=CC=C1)(C)[H])(=O)CBr
Spectrum/Structure Validation Score (Vapor Phase IR) 0.907032