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N,N-Dimethyl-4-chloro-2,5-dimethoxyamphetamine

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

N,N-Dimethyl-4-chloro-2,5-dimethoxyamphetamine
SpectraBase Compound ID 3amr7Qxl9bh
InChI InChI=1S/C13H20ClNO2/c1-9(15(2)3)6-10-7-13(17-5)11(14)8-12(10)16-4/h7-9H,6H2,1-5H3
InChIKey SFUYASJLHFQSHD-UHFFFAOYSA-N
Mol Weight 257.76 g/mol
Molecular Formula C13H20ClNO2
Exact Mass 257.118257 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID I79MvzU4wNh
Name N,N-Dimethyl-4-chloro-2,5-dimethoxyamphetamine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 257.118256586 u
Formula C13H20ClNO2
InChI InChI=1S/C13H20ClNO2/c1-9(15(2)3)6-10-7-13(17-5)11(14)8-12(10)16-4/h7-9H,6H2,1-5H3
InChIKey SFUYASJLHFQSHD-UHFFFAOYSA-N
Molecular Weight 257.761 g/mol
SMILES C=1(C(=CC(=C(C1)OC)Cl)OC)CC(N(C)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.917566