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N-Cyclopentyl-3,4-methylenedioxyphenethylamine

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

N-Cyclopentyl-3,4-methylenedioxyphenethylamine
SpectraBase Compound ID 8U9kEcf93yM
InChI InChI=1S/C14H19NO2/c1-2-4-12(3-1)15-8-7-11-5-6-13-14(9-11)17-10-16-13/h5-6,9,12,15H,1-4,7-8,10H2
InChIKey DUJQCJAXCPYNNC-UHFFFAOYSA-N
Mol Weight 233.31 g/mol
Molecular Formula C14H19NO2
Exact Mass 233.141579 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1CFsPD37adt
Name N-Cyclopentyl-3,4-methylenedioxyphenethylamine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 233.141578854 u
Formula C14H19NO2
InChI InChI=1S/C14H19NO2/c1-2-4-12(3-1)15-8-7-11-5-6-13-14(9-11)17-10-16-13/h5-6,9,12,15H,1-4,7-8,10H2
InChIKey DUJQCJAXCPYNNC-UHFFFAOYSA-N
Molecular Weight 233.311 g/mol
SMILES C1=2C(=CC=C(C2)CCNC2CCCC2)OCO1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.915482