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2-Chloroethyl N-propyl sulfide
SpectraBase Compound ID HduQ6dAzpI9
InChI InChI=1S/C5H11ClS/c1-2-4-7-5-3-6/h2-5H2,1H3
InChIKey LAZDGCFXCRZCPW-UHFFFAOYSA-N
Mol Weight 138.66 g/mol
Molecular Formula C5H11ClS
Exact Mass 138.026999 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BVi21scN8J8
Name 2-Chloroethyl N-propyl sulfide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 138.026999228 u
Formula C5H11ClS
InChI InChI=1S/C5H11ClS/c1-2-4-7-5-3-6/h2-5H2,1H3
InChIKey LAZDGCFXCRZCPW-UHFFFAOYSA-N
Molecular Weight 138.656 g/mol
SMILES C(CSCCC)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.873638