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N-(2-Butyl)-2-(3,4-methylenedioxyphenyl)propan-1-amine
SpectraBase Compound ID JNYfvkUpxZK
InChI InChI=1S/C14H21NO2/c1-4-11(3)15-8-10(2)12-5-6-13-14(7-12)17-9-16-13/h5-7,10-11,15H,4,8-9H2,1-3H3
InChIKey IFDUDCZCYHTVLS-UHFFFAOYSA-N
Mol Weight 235.33 g/mol
Molecular Formula C14H21NO2
Exact Mass 235.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Hmgf0e2WFk
Name N-(2-Butyl)-2-(3,4-methylenedioxyphenyl)propan-1-amine
Classification beta-isomeric amphetamine derivative
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 235.157228918 u
Formula C14H21NO2
InChI InChI=1S/C14H21NO2/c1-4-11(3)15-8-10(2)12-5-6-13-14(7-12)17-9-16-13/h5-7,10-11,15H,4,8-9H2,1-3H3
InChIKey IFDUDCZCYHTVLS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 235.327 g/mol
Nominal Mass 235 u
Quality 995
Retention Index 1705
SMILES C1=2C(=CC=C(C(CNC(CC)C)C)C2)OCO1
SPLASH splash10-000i-9200000000-0e93b54d3a400449f3d5
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(1-Methylpropyl)-2-(3,4-methylenedioxyphenyl)propan-1-amine
Technique GC/MS
Wiley ID DD2024_014716