For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

p-Chlorophenyl (2-(butylthio)ethyl)carbamate

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

p-Chlorophenyl (2-(butylthio)ethyl)carbamate
SpectraBase Compound ID 1T7XJeClMI1
InChI InChI=1S/C13H18ClNO2S/c1-2-3-9-18-10-8-15-13(16)17-12-6-4-11(14)5-7-12/h4-7H,2-3,8-10H2,1H3,(H,15,16)
InChIKey JSXDMTIKICCNDV-UHFFFAOYSA-N
Mol Weight 287.81 g/mol
Molecular Formula C13H18ClNO2S
Exact Mass 287.074678 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 11MJ6WNcnLq
Name p-Chlorophenyl (2-(butylthio)ethyl)carbamate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 287.074677696 u
Formula C13H18ClNO2S
InChI InChI=1S/C13H18ClNO2S/c1-2-3-9-18-10-8-15-13(16)17-12-6-4-11(14)5-7-12/h4-7H,2-3,8-10H2,1H3,(H,15,16)
InChIKey JSXDMTIKICCNDV-UHFFFAOYSA-N
SMILES C1=C(C=CC(=C1)Cl)OC(=O)NCCSCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.941564