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(3-Chloranyl-2-methoxy-propyl)sulfanylmethylbenzene
SpectraBase Compound ID Htwt4Fxcn5Z
InChI InChI=1S/C11H15ClOS/c1-13-11(7-12)9-14-8-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3
InChIKey HNSHDCPZWGSPMP-UHFFFAOYSA-N
Mol Weight 230.75 g/mol
Molecular Formula C11H15ClOS
Exact Mass 230.053214 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID A3LzPuC15Ws
Name (3-Chloranyl-2-methoxy-propyl)sulfanylmethylbenzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 230.053213976 u
Formula C11H15ClOS
InChI InChI=1S/C11H15ClOS/c1-13-11(7-12)9-14-8-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3
InChIKey HNSHDCPZWGSPMP-UHFFFAOYSA-N
Molecular Weight 230.753 g/mol
SMILES C(SCC=1C=CC=CC1)C(OC)CCl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.805284