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N-Isopentyl-2-(3,4-methylenedioxyphenyl)propan-1-amine
SpectraBase Compound ID 2vYAbkHwHhm
InChI InChI=1S/C15H23NO2/c1-11(2)6-7-16-9-12(3)13-4-5-14-15(8-13)18-10-17-14/h4-5,8,11-12,16H,6-7,9-10H2,1-3H3
InChIKey CUYXHCIVPRLMFD-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 5WjnFFZBmvw
Name N-Isopentyl-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/c1-11(2)6-7-16-9-12(3)13-4-5-14-15(8-13)18-10-17-14/h4-5,8,11-12,16H,6-7,9-10H2,1-3H3
InChIKey CUYXHCIVPRLMFD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 249.354 g/mol
Nominal Mass 249 u
Quality 979
Retention Index 1833
SMILES C1=2C(=CC=C(C(CNCCC(C)C)C)C2)OCO1
SPLASH splash10-0f6x-9700000000-d633e79cf0960efda309
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(3-Methylbutyl)-2-(3,4-methylenedioxyphenyl)propan-1-amine
Technique GC/MS
Wiley ID DD2024_014722