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N-(2-Pentyl)-2-(3,4-methylenedioxyphenyl)propan-1-amine
SpectraBase Compound ID JstTN7oejjs
InChI InChI=1S/C15H23NO2/c1-4-5-12(3)16-9-11(2)13-6-7-14-15(8-13)18-10-17-14/h6-8,11-12,16H,4-5,9-10H2,1-3H3
InChIKey ICWMVWMXUZHFIE-UHFFFAOYSA-N
Mol Weight 249.35 g/mol
Molecular Formula C15H23NO2
Exact Mass 249.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FYrAxLn4ZE
Name N-(2-Pentyl)-2-(3,4-methylenedioxyphenyl)propan-1-amine
Classification beta-isomeric amphetamine derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 249.172878983 u
Formula C15H23NO2
InChI InChI=1S/C15H23NO2/c1-4-5-12(3)16-9-11(2)13-6-7-14-15(8-13)18-10-17-14/h6-8,11-12,16H,4-5,9-10H2,1-3H3
InChIKey ICWMVWMXUZHFIE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 249.354 g/mol
Nominal Mass 249 u
Quality 932
Retention Index 1798
SMILES C1=2C(=CC=C(C(CNC(CCC)C)C)C2)OCO1
SPLASH splash10-0udi-6900000000-344ae66fee0b7e877be3
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(1-Methylbutyl)-2-(3,4-methylenedioxyphenyl)propan-1-amine
Technique GC/MS
Wiley ID DD2024_014721