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4-Isopentyl-N-isopropyl-3-methyl-5-oxothiomorpholine-3-carboxamide

View entire compound with spectra: 1 FTIR

4-Isopentyl-N-isopropyl-3-methyl-5-oxothiomorpholine-3-carboxamide
SpectraBase Compound ID AlOS07DP00Y
InChI InChI=1S/C14H26N2O2S/c1-10(2)6-7-16-12(17)8-19-9-14(16,5)13(18)15-11(3)4/h10-11H,6-9H2,1-5H3,(H,15,18)
InChIKey RORWJVQACLTDHU-UHFFFAOYSA-N
Mol Weight 286.43 g/mol
Molecular Formula C14H26N2O2S
Exact Mass 286.171499 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID J2GniHpHAnu
Name 4-Isopentyl-N-isopropyl-3-methyl-5-oxothiomorpholine-3-carboxamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 286.171499257 u
Formula C14H26N2O2S
InChI InChI=1S/C14H26N2O2S/c1-10(2)6-7-16-12(17)8-19-9-14(16,5)13(18)15-11(3)4/h10-11H,6-9H2,1-5H3,(H,15,18)
InChIKey RORWJVQACLTDHU-UHFFFAOYSA-N
SMILES C1(N(C(CSC1)=O)CCC(C)C)(C(=O)NC(C)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.808301