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

*Links on SpectraBase are not permalinks.

N-[1'-(Chloromethyl)-2'-[(phenylsulphonyl)ethyl]-2-propenamine

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

N-[1'-(Chloromethyl)-2'-[(phenylsulphonyl)ethyl]-2-propenamine
SpectraBase Compound ID 4NymfzKVjyh
InChI InChI=1S/C12H16ClNO2S/c1-2-8-14-11(9-13)10-17(15,16)12-6-4-3-5-7-12/h2-7,11,14H,1,8-10H2
InChIKey DNCWNYHMLQLNMO-UHFFFAOYSA-N
Mol Weight 273.78 g/mol
Molecular Formula C12H16ClNO2S
Exact Mass 273.059028 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 BOuch3qyIKS
Name N-[1'-(Chloromethyl)-2'-[(phenylsulphonyl)ethyl]-2-propenamine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 273.059027631 u
Formula C12H16ClNO2S
InChI InChI=1S/C12H16ClNO2S/c1-2-8-14-11(9-13)10-17(15,16)12-6-4-3-5-7-12/h2-7,11,14H,1,8-10H2
InChIKey DNCWNYHMLQLNMO-UHFFFAOYSA-N
SMILES C(S(=O)(=O)C=1C=CC=CC1)C(NCC=C)CCl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.962539