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2-[(4-Chlorobenzyl)amino]-2-methyl-1-propanol
SpectraBase Compound ID IGrVVPuEvMP
InChI InChI=1S/C11H16ClNO/c1-11(2,8-14)13-7-9-3-5-10(12)6-4-9/h3-6,13-14H,7-8H2,1-2H3
InChIKey MNZKAQWNFMEAFE-UHFFFAOYSA-N
Mol Weight 213.71 g/mol
Molecular Formula C11H16ClNO
Exact Mass 213.092042 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2iC8saB6XGQ
Name 2-[(4-Chlorobenzyl)amino]-2-methyl-1-propanol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 213.092041838 u
Formula C11H16ClNO
InChI InChI=1S/C11H16ClNO/c1-11(2,8-14)13-7-9-3-5-10(12)6-4-9/h3-6,13-14H,7-8H2,1-2H3
InChIKey MNZKAQWNFMEAFE-UHFFFAOYSA-N
Molecular Weight 213.708 g/mol
SMILES C1(Cl)=CC=C(C=C1)CNC(CO)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.818972