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5-Chlorovaleramide, N-(3,4-dimethoxyphenethyl)-

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

5-Chlorovaleramide, N-(3,4-dimethoxyphenethyl)-
SpectraBase Compound ID T6xcZ6CsvU
InChI InChI=1S/C15H22ClNO3/c1-19-13-7-6-12(11-14(13)20-2)8-10-17-15(18)5-3-4-9-16/h6-7,11H,3-5,8-10H2,1-2H3,(H,17,18)
InChIKey HTKOYEWYBNJTAA-UHFFFAOYSA-N
Mol Weight 299.8 g/mol
Molecular Formula C15H22ClNO3
Exact Mass 299.128821 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BhuqqkKFDON
Name 5-Chlorovaleramide, N-(3,4-dimethoxyphenethyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 299.128821269 u
Formula C15H22ClNO3
InChI InChI=1S/C15H22ClNO3/c1-19-13-7-6-12(11-14(13)20-2)8-10-17-15(18)5-3-4-9-16/h6-7,11H,3-5,8-10H2,1-2H3,(H,17,18)
InChIKey HTKOYEWYBNJTAA-UHFFFAOYSA-N
Molecular Weight 299.798 g/mol
SMILES C(Cl)CCCC(=O)NCCC=1C=C(OC)C(OC)=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.970019