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N-[2-(2-Chloro-5-nitrophenoxy)ethyl]-N,N-bis(2-hydroxyethyl)amine

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

N-[2-(2-Chloro-5-nitrophenoxy)ethyl]-N,N-bis(2-hydroxyethyl)amine
SpectraBase Compound ID 5DNrlv5HgCV
InChI InChI=1S/C12H17ClN2O5/c13-11-2-1-10(15(18)19)9-12(11)20-8-5-14(3-6-16)4-7-17/h1-2,9,16-17H,3-8H2
InChIKey BUSLZSFORXGTMV-UHFFFAOYSA-N
Mol Weight 304.73 g/mol
Molecular Formula C12H17ClN2O5
Exact Mass 304.082599 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1q5lpmKziiY
Name N-[2-(2-Chloro-5-nitrophenoxy)ethyl]-N,N-bis(2-hydroxyethyl)amine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 304.082599350 u
Formula C12H17ClN2O5
InChI InChI=1S/C12H17ClN2O5/c13-11-2-1-10(15(18)19)9-12(11)20-8-5-14(3-6-16)4-7-17/h1-2,9,16-17H,3-8H2
InChIKey BUSLZSFORXGTMV-UHFFFAOYSA-N
Molecular Weight 304.730 g/mol
SMILES C1=C(C(=CC=C1N(=O)=O)Cl)OCCN(CCO)CCO
Spectrum/Structure Validation Score (Vapor Phase IR) 0.925167