For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-(3,4-Methylenedioxyphenyl)-2-chloropropane
SpectraBase Compound ID HmH4eYV4gt1
InChI InChI=1S/C10H11ClO2/c1-7(11)4-8-2-3-9-10(5-8)13-6-12-9/h2-3,5,7H,4,6H2,1H3
InChIKey NOSSPDHLBXXMRA-UHFFFAOYSA-N
Mol Weight 198.65 g/mol
Molecular Formula C10H11ClO2
Exact Mass 198.044757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JGEm81HXMBM
Name 1-(3,4-Methylenedioxyphenyl)-2-chloropropane
Classification Designer drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 198.044757292 u
Formula C10H11ClO2
InChI InChI=1S/C10H11ClO2/c1-7(11)4-8-2-3-9-10(5-8)13-6-12-9/h2-3,5,7H,4,6H2,1H3
InChIKey NOSSPDHLBXXMRA-UHFFFAOYSA-N
Ionization Type Chemical Ionization (CI)
Molecular Weight 198.649 g/mol
Nominal Mass 198 u
Reagent Gas Methane
Retention Index 1422
SMILES C1=2C(=CC(=CC2)CC(Cl)C)OCO1
SPLASH splash10-03di-0900000000-b56446ab3f693a36b0c2
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 5-(2-chloropropyl)-1,3-benzodioxole
Technique GC/MS
Wiley ID DD2024_002221