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Valeramide, 5-chloro-N-(2-butyl)-N-(3-methylbutyl)-

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Valeramide, 5-chloro-N-(2-butyl)-N-(3-methylbutyl)-
SpectraBase Compound ID 8dK6GeXHWzD
InChI InChI=1S/C14H28ClNO/c1-5-13(4)16(11-9-12(2)3)14(17)8-6-7-10-15/h12-13H,5-11H2,1-4H3
InChIKey GFCCAOZRVXLXEA-UHFFFAOYSA-N
Mol Weight 261.84 g/mol
Molecular Formula C14H28ClNO
Exact Mass 261.185942 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 36f4VUdRXbT
Name Valeramide, 5-chloro-N-(2-butyl)-N-(3-methylbutyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 261.185942225 u
Formula C14H28ClNO
InChI InChI=1S/C14H28ClNO/c1-5-13(4)16(11-9-12(2)3)14(17)8-6-7-10-15/h12-13H,5-11H2,1-4H3
InChIKey GFCCAOZRVXLXEA-UHFFFAOYSA-N
Molecular Weight 261.837 g/mol
SMILES C(N(CCC(C)C)C(CC)C)(=O)CCCCCl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.90631