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1-(3,4-Methylenedioxyphenyl)butyl-1-chloride
SpectraBase Compound ID 9gD1e2ji94F
InChI InChI=1S/C11H13ClO2/c1-2-3-9(12)8-4-5-10-11(6-8)14-7-13-10/h4-6,9H,2-3,7H2,1H3
InChIKey JNXVWOUATKJZSN-UHFFFAOYSA-N
Mol Weight 212.68 g/mol
Molecular Formula C11H13ClO2
Exact Mass 212.060407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3izFwdxlqK
Name 1-(3,4-Methylenedioxyphenyl)butyl-1-chloride
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 212.060407357 u
Formula C11H13ClO2
InChI InChI=1S/C11H13ClO2/c1-2-3-9(12)8-4-5-10-11(6-8)14-7-13-10/h4-6,9H,2-3,7H2,1H3
InChIKey JNXVWOUATKJZSN-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 212.676 g/mol
Nominal Mass 212 u
Quality 789
Retention Index 1522
SMILES C1=2C(=CC=C(C(CCC)Cl)C2)OCO1
SPLASH splash10-08g0-6900000000-46ca0eb02c2f3798455b
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 5-(1-chlorobutyl)-1,3-benzodioxole
Technique GC/MS
Wiley ID DD2024_002218