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Benzamide, 2-chloro-N-(3-methylbutyl)-

View entire compound with spectra: 1 NMR, and 1 FTIR

Benzamide, 2-chloro-N-(3-methylbutyl)-
SpectraBase Compound ID Gy1OylRnUa8
InChI InChI=1S/C12H16ClNO/c1-9(2)7-8-14-12(15)10-5-3-4-6-11(10)13/h3-6,9H,7-8H2,1-2H3,(H,14,15)
InChIKey PGNJNTVXQORETO-UHFFFAOYSA-N
Mol Weight 225.72 g/mol
Molecular Formula C12H16ClNO
Exact Mass 225.092042 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5J9qX0bHmVv
Name Benzamide, 2-chloro-N-(3-methylbutyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 225.092041838 u
Formula C12H16ClNO
InChI InChI=1S/C12H16ClNO/c1-9(2)7-8-14-12(15)10-5-3-4-6-11(10)13/h3-6,9H,7-8H2,1-2H3,(H,14,15)
InChIKey PGNJNTVXQORETO-UHFFFAOYSA-N
Molecular Weight 225.719 g/mol
SMILES C(NCCC(C)C)(=O)C=1C=CC=CC1Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.869401